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

Systemtic Name: N-cyclohexyl-N-methyl-2-(octanoylcarbamothioylamino)benzamide Openeye Name: N-cyclohexyl-N-methyl-2-(octanoylcarbamothioylamino)benzamide CAS Name: N-cyclohexyl-N-methyl-2-[[(1-oxooctylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-N-methyl-2-(octanoylcarbamothioylamino)benzamide Traditional Name: 2-(caprylylthiocarbamoylamino)-N-cyclohexyl-N-methyl-benzamide Formula: C23H35N3O2S MolecularWeight: 417.6079

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(C)C2CCCCC2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(C)C2CCCCC2

InChI

InChI=1S/C23H35N3O2S/c1-3-4-5-6-10-17-21(27)25-23(29)24-20-16-12-11-15-19(20)22(28)26(2)18-13-8-7-9-14-18/h11-12,15-16,18H,3-10,13-14,17H2,1-2H3,(H2,24,25,27,29)