Organoheterocyclic compounds
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Azepan-2-one oxime, 97%, Thermo Scientific™
CAS: 19214-08-5 Molecular Formula: C6H12N2O Molecular Weight (g/mol): 128.18 MDL Number: MFCD00053062 InChI Key: PPOHPUOKXMNCCI-UHFFFAOYSA-N Synonym: azepan-2-one oxime,n-azepan-2-ylidene hydroxylamine,2z-azepan-2-one oxime,2h-azepin-7-amine,3,4,5,6-tetrahydro-n-hydroxy,n-2e-azepan-2-ylidene hydroxylamine,2-hydroxyimino azaperhydroepine,n-2z-azepan-2-ylidene hydroxylamine,caprolactam-oxime,hieh@hpdeewafjjadp,azepan-2-oneoxime PubChem CID: 1810625 IUPAC Name: N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydroxylamine SMILES: O\N=C1/CCCCCN1
| PubChem CID | 1810625 |
|---|---|
| CAS | 19214-08-5 |
| Molecular Weight (g/mol) | 128.18 |
| MDL Number | MFCD00053062 |
| SMILES | O\N=C1/CCCCCN1 |
| Synonym | azepan-2-one oxime,n-azepan-2-ylidene hydroxylamine,2z-azepan-2-one oxime,2h-azepin-7-amine,3,4,5,6-tetrahydro-n-hydroxy,n-2e-azepan-2-ylidene hydroxylamine,2-hydroxyimino azaperhydroepine,n-2z-azepan-2-ylidene hydroxylamine,caprolactam-oxime,hieh@hpdeewafjjadp,azepan-2-oneoxime |
| IUPAC Name | N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydroxylamine |
| InChI Key | PPOHPUOKXMNCCI-UHFFFAOYSA-N |
| Molecular Formula | C6H12N2O |
2-Amino-4-(3-pyridyl)thiazole, 97%, Thermo Scientific™
CAS: 30235-27-9 Molecular Formula: C8H7N3S Molecular Weight (g/mol): 177.225 MDL Number: MFCD00218013 InChI Key: XOHZQGAYUHOJPR-UHFFFAOYSA-N Synonym: 4-pyridin-3-yl thiazol-2-amine,2-amino-4-3-pyridyl thiazole,4-pyridin-3-yl-thiazol-2-ylamine,4-pyridin-3-yl-1,3-thiazol-2-amine,4-3-pyridinyl-2-thiazolamine,2-thiazolamine, 4-3-pyridinyl,ccris 6699,2-amino-4-pyridin-3-yl-1,3-thiazole,4-pyridine-3-yl-thiazol-2-ylamine,4-3-pyridinyl-1,3-thiazol-2-ylamine PubChem CID: 154893 IUPAC Name: 4-pyridin-3-yl-1,3-thiazol-2-amine SMILES: C1=CC(=CN=C1)C2=CSC(=N2)N
| PubChem CID | 154893 |
|---|---|
| CAS | 30235-27-9 |
| Molecular Weight (g/mol) | 177.225 |
| MDL Number | MFCD00218013 |
| SMILES | C1=CC(=CN=C1)C2=CSC(=N2)N |
| Synonym | 4-pyridin-3-yl thiazol-2-amine,2-amino-4-3-pyridyl thiazole,4-pyridin-3-yl-thiazol-2-ylamine,4-pyridin-3-yl-1,3-thiazol-2-amine,4-3-pyridinyl-2-thiazolamine,2-thiazolamine, 4-3-pyridinyl,ccris 6699,2-amino-4-pyridin-3-yl-1,3-thiazole,4-pyridine-3-yl-thiazol-2-ylamine,4-3-pyridinyl-1,3-thiazol-2-ylamine |
| IUPAC Name | 4-pyridin-3-yl-1,3-thiazol-2-amine |
| InChI Key | XOHZQGAYUHOJPR-UHFFFAOYSA-N |
| Molecular Formula | C8H7N3S |
2-Methyl-1,3-thiazole-4-carboximidamide hydrochloride, 97%, Thermo Scientific™
CAS: 18876-82-9 Molecular Formula: C5H8ClN3S Molecular Weight (g/mol): 177.65 MDL Number: MFCD00178765 InChI Key: YYLYRAUCGUIGIE-UHFFFAOYSA-N Synonym: 2-methyl-1,3-thiazole-4-carboximidamide hydrochloride,2-methylthiazole-4-carboxamidine hydrochloride,2-methyl-thiazole-4-carboxamidine hydrochloride,2-methylthiazole-4-carboximidamide hydrochloride,2-methyl-1,3-thiazole-4-carboxamidine, chloride,4-thiazolecarboximidamide,2-methyl-,hydrochloride 1:1 PubChem CID: 2799402 IUPAC Name: 2-methyl-1,3-thiazole-4-carboximidamide;hydrochloride SMILES: CC1=NC(=CS1)C(=N)N.Cl
| PubChem CID | 2799402 |
|---|---|
| CAS | 18876-82-9 |
| Molecular Weight (g/mol) | 177.65 |
| MDL Number | MFCD00178765 |
| SMILES | CC1=NC(=CS1)C(=N)N.Cl |
| Synonym | 2-methyl-1,3-thiazole-4-carboximidamide hydrochloride,2-methylthiazole-4-carboxamidine hydrochloride,2-methyl-thiazole-4-carboxamidine hydrochloride,2-methylthiazole-4-carboximidamide hydrochloride,2-methyl-1,3-thiazole-4-carboxamidine, chloride,4-thiazolecarboximidamide,2-methyl-,hydrochloride 1:1 |
| IUPAC Name | 2-methyl-1,3-thiazole-4-carboximidamide;hydrochloride |
| InChI Key | YYLYRAUCGUIGIE-UHFFFAOYSA-N |
| Molecular Formula | C5H8ClN3S |
2-(4-Pyridyl)thiazole-4-carboxylic acid, 97%
CAS: 21278-86-4 Molecular Formula: C9H5N2O2S Molecular Weight (g/mol): 205.21 MDL Number: MFCD00171745 InChI Key: COOQMBOJAAZEIR-UHFFFAOYSA-M Synonym: 2-pyridin-4-yl thiazole-4-carboxylic acid,2-4-pyridyl thiazole-4-carboxylic acid,2-pyridin-4-yl-1,3-thiazole-4-carboxylic acid,2-4-pyridyl-1,3-thiazole-4-carboxylic acid,2-4-pyridinyl-1,3-thiazole-4-carboxylic acid,2-pyridin-4-yl-thiazole-4-carboxylic acid,4-thiazolecarboxylicacid, 2-4-pyridinyl,acmc-1cr1v,4-thiazolecarboxylic acid, 2-4-pyridinyl,4-carboxy-2-4-pyridyl thiazole PubChem CID: 716091 SMILES: [O-]C(=O)C1=CSC(=N1)C1=CC=NC=C1
| PubChem CID | 716091 |
|---|---|
| CAS | 21278-86-4 |
| Molecular Weight (g/mol) | 205.21 |
| MDL Number | MFCD00171745 |
| SMILES | [O-]C(=O)C1=CSC(=N1)C1=CC=NC=C1 |
| Synonym | 2-pyridin-4-yl thiazole-4-carboxylic acid,2-4-pyridyl thiazole-4-carboxylic acid,2-pyridin-4-yl-1,3-thiazole-4-carboxylic acid,2-4-pyridyl-1,3-thiazole-4-carboxylic acid,2-4-pyridinyl-1,3-thiazole-4-carboxylic acid,2-pyridin-4-yl-thiazole-4-carboxylic acid,4-thiazolecarboxylicacid, 2-4-pyridinyl,acmc-1cr1v,4-thiazolecarboxylic acid, 2-4-pyridinyl,4-carboxy-2-4-pyridyl thiazole |
| InChI Key | COOQMBOJAAZEIR-UHFFFAOYSA-M |
| Molecular Formula | C9H5N2O2S |
N,2-Dimethyl-(1,3-thiazol-4-yl)methylamine, 97%, Thermo Scientific™
CAS: 144163-81-5 Molecular Formula: C6H10N2S Molecular Weight (g/mol): 142.22 MDL Number: MFCD06738964 InChI Key: GJHOBSIOQKGKSG-UHFFFAOYSA-N Synonym: methyl-2-methyl-thiazol-4-ylmethyl-amine,methyl-2-methylthiazole-4-yl methyl amine,n-methyl-1-2-methylthiazol-4-yl methanamine,methyl 2-methyl-1,3-thiazol-4-yl methyl amine,4-thiazolemethanamine,n,2-dimethyl,n-methyl 2-methylthiazol-4-yl methanamine,4-thiazolemethanamine, n,2-dimethyl,n-methyl-1-2-methyl-1,3-thiazol-4-yl methanamine,n,2-dimethyl-1,3-thiazol-4-yl methylamine,2-methyl-4-methyl aminomethyl-1,3-thiazole PubChem CID: 18939489 IUPAC Name: N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine SMILES: CC1=NC(=CS1)CNC
| PubChem CID | 18939489 |
|---|---|
| CAS | 144163-81-5 |
| Molecular Weight (g/mol) | 142.22 |
| MDL Number | MFCD06738964 |
| SMILES | CC1=NC(=CS1)CNC |
| Synonym | methyl-2-methyl-thiazol-4-ylmethyl-amine,methyl-2-methylthiazole-4-yl methyl amine,n-methyl-1-2-methylthiazol-4-yl methanamine,methyl 2-methyl-1,3-thiazol-4-yl methyl amine,4-thiazolemethanamine,n,2-dimethyl,n-methyl 2-methylthiazol-4-yl methanamine,4-thiazolemethanamine, n,2-dimethyl,n-methyl-1-2-methyl-1,3-thiazol-4-yl methanamine,n,2-dimethyl-1,3-thiazol-4-yl methylamine,2-methyl-4-methyl aminomethyl-1,3-thiazole |
| IUPAC Name | N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine |
| InChI Key | GJHOBSIOQKGKSG-UHFFFAOYSA-N |
| Molecular Formula | C6H10N2S |
2-Methylbenzothiazole, 99%
CAS: 120-75-2 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.21 InChI Key: DXYYSGDWQCSKKO-UHFFFAOYSA-N Synonym: 2-methylbenzothiazole,benzothiazole, 2-methyl,2-methybenzothiazole,2-methyl-benzothiazole,benzothiazole, methyl,usaf ek-1853,unii-7lx1xe6h8w,2-methylbenzo d thiazole,2-methyl benzothiazole,7lx1xe6h8w PubChem CID: 8446 IUPAC Name: 2-methyl-1,3-benzothiazole SMILES: CC1=NC2=CC=CC=C2S1
| PubChem CID | 8446 |
|---|---|
| CAS | 120-75-2 |
| Molecular Weight (g/mol) | 149.21 |
| SMILES | CC1=NC2=CC=CC=C2S1 |
| Synonym | 2-methylbenzothiazole,benzothiazole, 2-methyl,2-methybenzothiazole,2-methyl-benzothiazole,benzothiazole, methyl,usaf ek-1853,unii-7lx1xe6h8w,2-methylbenzo d thiazole,2-methyl benzothiazole,7lx1xe6h8w |
| IUPAC Name | 2-methyl-1,3-benzothiazole |
| InChI Key | DXYYSGDWQCSKKO-UHFFFAOYSA-N |
| Molecular Formula | C8H7NS |
Imidazole, Reagent, 99%, Spectrum™ Chemical
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CAS: 288-32-4 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005183 InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N IUPAC Name: 1H-imidazole SMILES: N1C=CN=C1
| CAS | 288-32-4 |
|---|---|
| Molecular Weight (g/mol) | 68.08 |
| MDL Number | MFCD00005183 |
| SMILES | N1C=CN=C1 |
| IUPAC Name | 1H-imidazole |
| InChI Key | RAXXELZNTBOGNW-UHFFFAOYSA-N |
| Molecular Formula | C3H4N2 |
4-Methylindole, 99%
CAS: 16096-32-5 Molecular Formula: C9H9N Molecular Weight (g/mol): 131.18 MDL Number: MFCD00005668 InChI Key: PZOUSPYUWWUPPK-UHFFFAOYSA-N Synonym: 4-methylindole,4-methyindole,1h-indole, 4-methyl,indole, 4-methyl,4-methyl indole,4-methyl-indole,pubchem7233,acmc-1bpu3,ksc179o0l PubChem CID: 85282 IUPAC Name: 4-methyl-1H-indole SMILES: CC1=C2C=CNC2=CC=C1
| PubChem CID | 85282 |
|---|---|
| CAS | 16096-32-5 |
| Molecular Weight (g/mol) | 131.18 |
| MDL Number | MFCD00005668 |
| SMILES | CC1=C2C=CNC2=CC=C1 |
| Synonym | 4-methylindole,4-methyindole,1h-indole, 4-methyl,indole, 4-methyl,4-methyl indole,4-methyl-indole,pubchem7233,acmc-1bpu3,ksc179o0l |
| IUPAC Name | 4-methyl-1H-indole |
| InChI Key | PZOUSPYUWWUPPK-UHFFFAOYSA-N |
| Molecular Formula | C9H9N |
| CAS | 3420-02-8 |
|---|---|
| MDL Number | MFCD00005682 |
Isoquinoline-1-carbonitrile, 99%
CAS: 1198-30-7 Molecular Formula: C10H6N2 Molecular Weight (g/mol): 154.172 MDL Number: MFCD00134166 InChI Key: HJHXYSBRTVFEDD-UHFFFAOYSA-N Synonym: 1-cyanoisoquinoline,1-isoquinolinecarbonitrile,isoquinaldonitrile,isoquinolinecarbonitrile,1-cyano-isoquinoline,isoquinaldinic nitrile,pubchem6269,maybridge1_002114,timtec-bb sbb002487 PubChem CID: 306057 IUPAC Name: isoquinoline-1-carbonitrile SMILES: C1=CC=C2C(=C1)C=CN=C2C#N
| PubChem CID | 306057 |
|---|---|
| CAS | 1198-30-7 |
| Molecular Weight (g/mol) | 154.172 |
| MDL Number | MFCD00134166 |
| SMILES | C1=CC=C2C(=C1)C=CN=C2C#N |
| Synonym | 1-cyanoisoquinoline,1-isoquinolinecarbonitrile,isoquinaldonitrile,isoquinolinecarbonitrile,1-cyano-isoquinoline,isoquinaldinic nitrile,pubchem6269,maybridge1_002114,timtec-bb sbb002487 |
| IUPAC Name | isoquinoline-1-carbonitrile |
| InChI Key | HJHXYSBRTVFEDD-UHFFFAOYSA-N |
| Molecular Formula | C10H6N2 |
2-Cyanopyridine, 99%
CAS: 100-70-9 Molecular Formula: C6H4N2 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00006218 InChI Key: FFNVQNRYTPFDDP-UHFFFAOYSA-N Synonym: 2-cyanopyridine,picolinonitrile,2-pyridinecarbonitrile,pyridinecarbonitrile,2-pyridyl nitrile,picolinic acid nitrile,cyanopyridine,unii-whr1dpg7ys,2-pyridinecarboxylic acid, nitrile,2-cyano pyridine PubChem CID: 7522 ChEBI: CHEBI:27837 IUPAC Name: pyridine-2-carbonitrile SMILES: C1=CC=NC(=C1)C#N
| PubChem CID | 7522 |
|---|---|
| CAS | 100-70-9 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:27837 |
| MDL Number | MFCD00006218 |
| SMILES | C1=CC=NC(=C1)C#N |
| Synonym | 2-cyanopyridine,picolinonitrile,2-pyridinecarbonitrile,pyridinecarbonitrile,2-pyridyl nitrile,picolinic acid nitrile,cyanopyridine,unii-whr1dpg7ys,2-pyridinecarboxylic acid, nitrile,2-cyano pyridine |
| IUPAC Name | pyridine-2-carbonitrile |
| InChI Key | FFNVQNRYTPFDDP-UHFFFAOYSA-N |
| Molecular Formula | C6H4N2 |
2,7-Dibromocarbazole
CAS: 136630-39-2 Molecular Formula: C12H7Br2N Molecular Weight (g/mol): 325.00 InChI Key: QPTWWBLGJZWRAV-UHFFFAOYSA-N IUPAC Name: 2,7-dibromo-9H-carbazole SMILES: BrC1=CC2=C(C=C1)C1=C(N2)C=C(Br)C=C1
| CAS | 136630-39-2 |
|---|---|
| Molecular Weight (g/mol) | 325.00 |
| SMILES | BrC1=CC2=C(C=C1)C1=C(N2)C=C(Br)C=C1 |
| IUPAC Name | 2,7-dibromo-9H-carbazole |
| InChI Key | QPTWWBLGJZWRAV-UHFFFAOYSA-N |
| Molecular Formula | C12H7Br2N |
(2-Methyl-3-furyl)methanol, 97%, Thermo Scientific™
CAS: 5554-99-4 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00052572 InChI Key: FTYOGLDPNBZSQC-UHFFFAOYSA-N PubChem CID: 2777165 IUPAC Name: (2-methylfuran-3-yl)methanol SMILES: CC1=C(C=CO1)CO
| PubChem CID | 2777165 |
|---|---|
| CAS | 5554-99-4 |
| Molecular Weight (g/mol) | 112.128 |
| MDL Number | MFCD00052572 |
| SMILES | CC1=C(C=CO1)CO |
| IUPAC Name | (2-methylfuran-3-yl)methanol |
| InChI Key | FTYOGLDPNBZSQC-UHFFFAOYSA-N |
| Molecular Formula | C6H8O2 |
2-Mercaptobenzothiazole, Spectrum™ Chemical
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CAS: 149-30-4
| CAS | 149-30-4 |
|---|