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

Systemtic Name: 2-(phenylmethylsulfanyl)-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)acetamide CAS Name: 2-(phenylmethylthio)-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)acetamide IUPAC Name: 2-benzylsulfanyl-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)acetamide Traditional Name: 2-(benzylthio)-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)acetamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S2/c1-2-13-28(25,26)23-12-6-9-18-14-19(10-11-20(18)23)22-21(24)16-27-15-17-7-4-3-5-8-17/h3-5,7-8,10-11,14H,2,6,9,12-13,15-16H2,1H3,(H,22,24)