N-butyl-2-[3-(phenylmethylsulfanyl)propanoylamino]benzamide

Systemtic Name: N-butyl-2-[3-(phenylmethylsulfanyl)propanoylamino]benzamide Openeye Name: 2-(3-benzylsulfanylpropanoylamino)-N-butyl-benzamide CAS Name: N-butyl-2-[[1-oxo-3-(phenylmethylthio)propyl]amino]benzamide IUPAC Name: 2-(3-benzylsulfanylpropanoylamino)-N-butylbenzamide Traditional Name: 2-[3-(benzylthio)propanoylamino]-N-butyl-benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)CCSCC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)CCSCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-2-3-14-22-21(25)18-11-7-8-12-19(18)23-20(24)13-15-26-16-17-9-5-4-6-10-17/h4-12H,2-3,13-16H2,1H3,(H,22,25)(H,23,24)