N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-(6-chlorothiochroman-4-yl)propanamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)propanamide Traditional Name: 2-(benzylthio)-N-(6-chlorothiochroman-4-yl)propionamide Formula: C19H20ClNOS2 MolecularWeight: 377.9512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCSC2=C1C=C(C=C2)Cl)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1CCSC2=C1C=C(C=C2)Cl)SCC3=CC=CC=C3

InChI

InChI=1S/C19H20ClNOS2/c1-13(24-12-14-5-3-2-4-6-14)19(22)21-17-9-10-23-18-8-7-15(20)11-16(17)18/h2-8,11,13,17H,9-10,12H2,1H3,(H,21,22)