4-[[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[[2-(isopentylamino)-2-oxo-ethyl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[2-(3-methylbutylamino)-2-oxoethyl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[2-(3-methylbutylamino)-2-oxoethyl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[[2-(isoamylamino)-2-keto-ethyl]thio]methyl]-N-phenyl-benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CSCC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=O)CSCC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-16(2)12-13-22-20(24)15-26-14-17-8-10-18(11-9-17)21(25)23-19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3,(H,22,24)(H,23,25)