N-methyl-2-(octanoylcarbamothioylamino)-N-(phenylmethyl)benzamide

Systemtic Name: N-methyl-2-(octanoylcarbamothioylamino)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-methyl-2-(octanoylcarbamothioylamino)benzamide CAS Name: N-methyl-2-[[(1-oxooctylamino)-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-methyl-2-(octanoylcarbamothioylamino)benzamide Traditional Name: N-benzyl-2-(caprylylthiocarbamoylamino)-N-methyl-benzamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C24H31N3O2S/c1-3-4-5-6-10-17-22(28)26-24(30)25-21-16-12-11-15-20(21)23(29)27(2)18-19-13-8-7-9-14-19/h7-9,11-16H,3-6,10,17-18H2,1-2H3,(H2,25,26,28,30)