N,N-diethyl-3-[2-(phenylmethylsulfanyl)propanoylamino]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C(C)SCC2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C(C)SCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-4-23(5-2)21(25)18-12-9-13-19(14-18)22-20(24)16(3)26-15-17-10-7-6-8-11-17/h6-14,16H,4-5,15H2,1-3H3,(H,22,24)