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CAS RN 188844-52-2

H3CSNOOHCH3H3CCH3

CAS RN 188844-52-2

IUPAC Name: 4-{14,14,17,17-tetramethyl-2-thia-9-azatetracyclo[9.8.0.0³,⁸.0¹³,¹⁸]nonadeca-1(19),3,5,7,9,11,13(18)-heptaen-10-yl}benzoic acid
Synonyms: 4-{14,14,17,17-tetramethyl-2-thia-9-azatetracyclo[9.8.0.0³,⁸.0¹³,¹⁸]nonadeca-1(19),3,5,7,9,11,13(18)-heptaen-10-yl}benzoic acid
Molecular Weight (g/mol): 441.59
Molecular Formula: C28H27NO2S
InChi Key: PFGCWQPTOKPRRK-UHFFFAOYSA-N
SMILES: CC1(C)CCC(C)(C)C2=C1C=C1SC3=CC=CC=C3N=C(C3=CC=C(C=C3)C(O)=O)C1=C2
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HX 630, Tocris Bioscience™

CAS: 188844-52-2 Molecular Formula: C28H27NO2S Molecular Weight (g/mol): 441.589 InChI Key: PFGCWQPTOKPRRK-UHFFFAOYSA-N Synonym: 4-7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo b naphtho 2,3-f 1,4 thiazepin-12-yl-benzoic acid,benzoic acid, 4-7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo b naphtho 2,3-f 1,4 thiazepin-12-yl,4-7,7,10,10-tetramethyl-7,8,9,10-tetrahydro-5-thia-13-aza-benzo 4,5 cyclohepta 1,2-b naphthalen-12-yl-benzoic acid,4-7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo b naphtho 2,3-f 1,4 thiazepin-12-yl benzoic acid,4-14,14,17,17-tetramethyl-2-thia-9-azatetracyclo 9.8.0.0 3 ,?.0 1 3 , 1 ? nonadeca-1 19 ,3,5,7,9,11,13 18-heptaen-10-yl benzoic acid PubChem CID: 9889522 IUPAC Name: 4-(7,7,10,10-tetramethyl-8,9-dihydronaphtho[2,3-b][1,5]benzothiazepin-12-yl)benzoic acid SMILES: CC1(CCC(C2=C1C=C3C(=C2)SC4=CC=CC=C4N=C3C5=CC=C(C=C5)C(=O)O)(C)C)C

PubChem CID 9889522
CAS 188844-52-2
Molecular Weight (g/mol) 441.589
SMILES CC1(CCC(C2=C1C=C3C(=C2)SC4=CC=CC=C4N=C3C5=CC=C(C=C5)C(=O)O)(C)C)C
Synonym 4-7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo b naphtho 2,3-f 1,4 thiazepin-12-yl-benzoic acid,benzoic acid, 4-7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo b naphtho 2,3-f 1,4 thiazepin-12-yl,4-7,7,10,10-tetramethyl-7,8,9,10-tetrahydro-5-thia-13-aza-benzo 4,5 cyclohepta 1,2-b naphthalen-12-yl-benzoic acid,4-7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo b naphtho 2,3-f 1,4 thiazepin-12-yl benzoic acid,4-14,14,17,17-tetramethyl-2-thia-9-azatetracyclo 9.8.0.0 3 ,?.0 1 3 , 1 ? nonadeca-1 19 ,3,5,7,9,11,13 18-heptaen-10-yl benzoic acid
IUPAC Name 4-(7,7,10,10-tetramethyl-8,9-dihydronaphtho[2,3-b][1,5]benzothiazepin-12-yl)benzoic acid
InChI Key PFGCWQPTOKPRRK-UHFFFAOYSA-N
Molecular Formula C28H27NO2S