Benzene and substituted derivatives
Ethyl hippurate, 96%
CAS: 1499-53-2 Molecular Formula: C11H13NO3 Molecular Weight (g/mol): 207.23 MDL Number: MFCD00026890 InChI Key: PTXRQIPIELXJFH-UHFFFAOYSA-N Synonym: ethyl hippurate,ethyl n-benzoylglycinate,n-benzoylglycine ethyl ester,ethyl 2-phenylformamido acetate,benzoic amide, n-ethoxycarbonyl methyl,ethylhippurate,ethyl benzoylaminoacetate,acmc-1buir,hippuric acid ethyl ester,maybridge1_006087 PubChem CID: 226558 IUPAC Name: ethyl 2-benzamidoacetate SMILES: CCOC(=O)CNC(=O)C1=CC=CC=C1
Methotrexate disodium salt, 98.5%
CAS: 7413-34-5 Molecular Formula: C20H20N8Na2O5 Molecular Weight (g/mol): 498.411 MDL Number: MFCD00274560 InChI Key: DASQOOZCTWOQPA-GXKRWWSZSA-L Synonym: methotrexate disodium salt,sodium methotrexate,ledertrexate,methotrexate sodium,mtx disodium,methotrexate disodium,unii-3ig1e710zn,trexall,mexate,methotrexate lpf PubChem CID: 11329481 ChEBI: CHEBI:50679 IUPAC Name: disodium;(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioate SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)[O-].[Na+].[Na+]
N-Benzylbenzamide, 99%
CAS: 1485-70-7 Molecular Formula: C14H13NO Molecular Weight (g/mol): 211.26 MDL Number: MFCD00003070 InChI Key: LKQUCICFTHBFAL-UHFFFAOYSA-N Synonym: benzamide, n-phenylmethyl,n-benzyl-benzamide,phenyl-n-benzylcarboxamide,benzoylbenzylamine,n∼1∼-benzylbenzamide,benzamide, n-benzyl,n-phenylmethyl benzamide,acmc-1bx9y,n-benzylbenzamide,lkqucicfthbfal-uhfffaoysa PubChem CID: 73878 IUPAC Name: N-benzylbenzamide SMILES: O=C(NCC1=CC=CC=C1)C1=CC=CC=C1
L(+)-Amethopterin hydrate, 99%
CAS: 133073-73-1 Molecular Formula: C20H22N8O5 Molecular Weight (g/mol): 454.45 MDL Number: MFCD00150847 InChI Key: FBOZXECLQNJBKD-UGPWUYPHNA-N Synonym: l +-amethopterin dihydrate,methotrexate dihydrate,dihydrate methotrexate,2s-2-4-2,4-diaminopteridin-6-yl methyl methylamino phenyl carbonylamino pentanedioic acid, hydrate, hydrate PubChem CID: 45157423 IUPAC Name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid;dihydrate SMILES: CN(CC1=CN=C2N=C(N)N=C(N)C2=N1)C1=CC=C(C=C1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
3-Bromo-1-(phenylsulfonyl)indole, 97%
CAS: 99655-68-2 Molecular Formula: C14H10BrNO2S Molecular Weight (g/mol): 336.20 MDL Number: MFCD02681986 InChI Key: MXPFKHHDXIJNDX-UHFFFAOYSA-N Synonym: 3-bromo-1-phenylsulfonyl-1h-indole,1-benzenesulfonyl-3-bromoindole,3-bromo-1-phenylsulfonyl indole,1-benzenesulfonyl-3-bromo-1h-indole,1-phenylsulfonyl-3-bromoindole,1-benzenesulphonyl-3-bromo-1h-indole,3-bromo-1-phenylsulphonyl-1h-indole,3-bromo-1-benzenesulphonylindole,1h-indole, 3-bromo-1-phenylsulfonyl PubChem CID: 2776215 IUPAC Name: 1-(benzenesulfonyl)-3-bromo-1H-indole SMILES: BrC1=CN(C2=CC=CC=C12)S(=O)(=O)C1=CC=CC=C1
5-Acetamido-2-aminobenzoic acid, 97%
CAS: 50670-83-2 Molecular Formula: C9H10N2O3 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00060120 InChI Key: GSOHXJQXAKNJES-UHFFFAOYSA-N Synonym: 5-acetamidoanthranilic acid,2-amino-5-acetamidobenzoic acid,benzoic acid, 5-acetylamino-2-amino,5-acetylamino-2-aminobenzoic acid,5-acetamino-2-aminobenzoic acid,5-acetamidoanthranilicacid,acmc-209kp2,5-acetylaminoanthanilic acid,5-acetamido-2-aminobenzoicacid,2-amino-5-acetaminobenzoic acid PubChem CID: 170890 IUPAC Name: 5-acetamido-2-aminobenzoic acid SMILES: CC(=O)NC1=CC(=C(C=C1)N)C(=O)O
3-Acetamidobenzoic acid, 98%
CAS: 587-48-4 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD00013983 InChI Key: RGDPZMQZWZMONQ-UHFFFAOYSA-N Synonym: 3-acetylamino benzoic acid,benzoic acid, 3-acetylamino,3-acetylaminobenzoic acid,m-acetylaminobenzoic acid,benzoic acid, m-acetamido,n-acetyl-m-aminobenzoic acid,3-acetylamino-benzoic acid,3-acetylamino-benzoicaci,3-acetamidobenzoicacid,3'-carboxyacetanilide PubChem CID: 48847 IUPAC Name: 3-acetamidobenzoic acid SMILES: CC(=O)NC1=CC=CC(=C1)C(=O)O
2-Methoxy-4-methylbenzenesulfonamide, 95%
CAS: 59554-39-1 Molecular Formula: C8H11NO3S Molecular Weight (g/mol): 201.24 MDL Number: MFCD01318156 InChI Key: GQUFSEOISDLWMN-UHFFFAOYSA-N Synonym: 2-methoxy-4-methyl-benzenesulfonamide,2-methoxy-4-methylbenzene-1-sulfonamide,acmc-20ans2,3-methoxy-p-toluenesulfonamide,benzenesulfonamide,2-methoxy-4-methyl,2-methoxy-4-methyl-1-benzenesulfonamide PubChem CID: 5093369 IUPAC Name: 2-methoxy-4-methylbenzenesulfonamide SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N)OC
4-Chloro-3-sulfamoylbenzoic acid, 98%
CAS: 1205-30-7 Molecular Formula: C7H6ClNO4S Molecular Weight (g/mol): 235.638 MDL Number: MFCD00012375 InChI Key: FHQAWINGVCDTTG-UHFFFAOYSA-N Synonym: 4-chloro-5-sulphamoylbenzoic acid,3-aminosulfonyl-4-chlorobenzoic acid,csba,sulfamido-3-chlorobenzoic acid,benzoic acid, 3-aminosulfonyl-4-chloro,3-sulfamoyl-4-chlorobenzoic acid,benzoic acid, 4-chloro-3-sulfamoyl,4-chloro-3-sulfamoyl-benzoic acid,4-chloro-5-sulfamoylbenzoic acid,4-chloro-3-sulphamoylbenzoic acid PubChem CID: 14568 IUPAC Name: 4-chloro-3-sulfamoylbenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Cl
S,S-Dimethyl-N-(p-toluenesulfonyl)sulfoximine, 98%
CAS: 22236-45-9 Molecular Formula: C9H13NO3S2 Molecular Weight (g/mol): 247.327 MDL Number: MFCD00013922 InChI Key: IRNAWARRPQUZDU-UHFFFAOYSA-N Synonym: s,s-dimethyl-n-p-toluenesulfonyl sulfoximine,s,s-dimethyl-n-p-tolylsulfonyl sulfoximine,dimethyl 4-methylbenzenesulfonyl imino-??-sulfanone,maybridge1_004531,s,s-dimethyl-n-p-tolylsulphonyl sulphoximide,dimethyl n-p-toluenesulfonyl sulfoximine,dimethyl-n-4-toluenesulfonyl sulfoximine,n-para-toluenesulfonyl dimethylsulfoximine,s.s-dimethyl-n-p-toluenesulfonyl sulfoximine,s,s-dimethyl-n-4-methylphenylsulfonyl sulfoximide PubChem CID: 99226 IUPAC Name: N-[dimethyl(oxo)-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N=S(=O)(C)C
Sulfamethazine sodium salt, MP Biomedicals™
CAS: 1981-58-4 Molecular Formula: C12H13N4NaO2S Molecular Weight (g/mol): 300.312 InChI Key: NGIVTUVVBWOTNT-UHFFFAOYSA-N Synonym: sulfamethazine sodium salt,sulfamethazine sodium,sulfadimidine sodium,sodium sulfamethazine,sodium sulfametazine,sodium sulfamethamide,sodium sulfamezathine,bovibol,vesadin,sodium sulfamethiazine PubChem CID: 13456556 IUPAC Name: sodium;(4-aminophenyl)sulfonyl-(4,6-dimethylpyrimidin-2-yl)azanide SMILES: CC1=CC(=NC(=N1)[N-]S(=O)(=O)C2=CC=C(C=C2)N)C.[Na+]
methyl 2-(morpholinosulfonyl)benzoate, 95%, Thermo Scientific™
CAS: 502182-56-1 Molecular Formula: C12H15NO5S Molecular Weight (g/mol): 285.31 MDL Number: MFCD09879985 InChI Key: FJLVVZZMDOHEEM-UHFFFAOYSA-N Synonym: methyl 2-morpholinosulfonyl benzoate,methyl 2-morpholine-4-sulfonyl benzoate,methyl 2-morpholin-4-yl sulphonyl benzoate PubChem CID: 341073 IUPAC Name: methyl 2-morpholin-4-ylsulfonylbenzoate SMILES: COC(=O)C1=CC=CC=C1S(=O)(=O)N1CCOCC1
Sulfacetamide sodium salt hydrate, 99%
CAS: 6209-17-2 Molecular Formula: C8H9N2NaO3S Molecular Weight (g/mol): 236.22 MDL Number: MFCD00007885 InChI Key: PQMSFAORUFMASU-UHFFFAOYSA-M Synonym: sodium sulfacetamide,sulfacetamide sodium monohydrate,sulfacetamide sodium salt hydrate,sulfacetamide sodic hydrate,unii-4nrt660kjq,sulfacetamide sodium usp,cetamide,sulfair forte,sulfair 10,4nrt660kjq PubChem CID: 6419954 ChEBI: CHEBI:63858 IUPAC Name: sodium;acetyl-(4-aminophenyl)sulfonylazanide;hydrate SMILES: CC(=O)N([Na])S(=O)(=O)C1=CC=C(N)C=C1
2-Chlorobenzenesulfonamide, 98%
CAS: 6961-82-6 Molecular Formula: C6H6ClNO2S Molecular Weight (g/mol): 191.629 MDL Number: MFCD00051974 InChI Key: JCCBZCMSYUSCFM-UHFFFAOYSA-N Synonym: o-chlorobenzenesulfonamide,2-chlorobenzene-1-sulfonamide,benzenesulfonamide, 2-chloro,unii-4bt2i28a0c,benzenesulfonamide, o-chloro,2-chlorobenzenesulphonamide,2-chloro-benzenesulfonamide,chlorobenzenesulfonamide,o-chlorobenzenesulphonamide,benzenesulfonamide, chloro PubChem CID: 81410 IUPAC Name: 2-chlorobenzenesulfonamide SMILES: C1=CC=C(C(=C1)S(=O)(=O)N)Cl
3-Methoxybenzenesulfonamide, 97%, Thermo Scientific Chemicals
CAS: 58734-57-9 Molecular Formula: C7H9NO3S Molecular Weight (g/mol): 187.21 MDL Number: MFCD08704579 InChI Key: VBKIEQKVSHDVGH-UHFFFAOYSA-N PubChem CID: 14763060 IUPAC Name: 3-methoxybenzenesulfonamide SMILES: COC1=CC(=CC=C1)S(N)(=O)=O