N-(1-cyclopropylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(1-cyclopropylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]acetamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-3,4-dihydro-2H-quinolin-6-yl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]acetamide Traditional Name: 2-(benzylthio)-N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]acetamide Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NC(=O)CSCC3=CC=CC=C3)N(C1)C(=O)C4CC4

Isomeric SMILES

C1CC2=C(C=CC(=C2)NC(=O)CSCC3=CC=CC=C3)N(C1)C(=O)C4CC4

InChI

InChI=1S/C22H24N2O2S/c25-21(15-27-14-16-5-2-1-3-6-16)23-19-10-11-20-18(13-19)7-4-12-24(20)22(26)17-8-9-17/h1-3,5-6,10-11,13,17H,4,7-9,12,14-15H2,(H,23,25)