N-[2-(4-chlorophenyl)sulfanyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]-5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]acetamide Formula: C24H21ClN2O2S MolecularWeight: 436.95374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCC3=CC=CC=C3C2)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCC3=CC=CC=C3C2)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H21ClN2O2S/c1-16(28)26-22-14-18(6-11-23(22)30-21-9-7-20(25)8-10-21)24(29)27-13-12-17-4-2-3-5-19(17)15-27/h2-11,14H,12-13,15H2,1H3,(H,26,28)