N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]acetamide CAS Name: N-[1-(2-methyl-1-oxopropyl)-3,4-dihydro-2H-quinolin-7-yl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]acetamide Traditional Name: 2-(benzylthio)-N-(1-isobutyryl-3,4-dihydro-2H-quinolin-7-yl)acetamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC2=C1C=C(C=C2)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1CCCC2=C1C=C(C=C2)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2S/c1-16(2)22(26)24-12-6-9-18-10-11-19(13-20(18)24)23-21(25)15-27-14-17-7-4-3-5-8-17/h3-5,7-8,10-11,13,16H,6,9,12,14-15H2,1-2H3,(H,23,25)