N,N-diethyl-3-(octanoylcarbamothioylamino)benzamide

Systemtic Name: N,N-diethyl-3-(octanoylcarbamothioylamino)benzamide Openeye Name: N,N-diethyl-3-(octanoylcarbamothioylamino)benzamide CAS Name: N,N-diethyl-3-[[(1-oxooctylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N,N-diethyl-3-(octanoylcarbamothioylamino)benzamide Traditional Name: 3-(caprylylthiocarbamoylamino)-N,N-diethyl-benzamide Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)N(CC)CC

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)N(CC)CC

InChI

InChI=1S/C20H31N3O2S/c1-4-7-8-9-10-14-18(24)22-20(26)21-17-13-11-12-16(15-17)19(25)23(5-2)6-3/h11-13,15H,4-10,14H2,1-3H3,(H2,21,22,24,26)