4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-diphenyl-1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-diphenyl-1,3-thiazol-2-yl)benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-diphenylthiazol-2-yl)benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-diphenyl-2-thiazolyl)benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-diphenyl-1,3-thiazol-2-yl)benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-diphenylthiazol-2-yl)benzamide Formula: C31H25N3O3S2 MolecularWeight: 551.6785

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=NC(=C(S4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=NC(=C(S4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H25N3O3S2/c35-30(33-31-32-28(23-10-3-1-4-11-23)29(38-31)24-12-5-2-6-13-24)25-15-17-27(18-16-25)39(36,37)34-20-19-22-9-7-8-14-26(22)21-34/h1-18H,19-21H2,(H,32,33,35)