N-cyclohexyl-2-[methyl(3-methylbutanoylcarbamothioyl)amino]benzamide

Systemtic Name: N-cyclohexyl-2-[methyl(3-methylbutanoylcarbamothioyl)amino]benzamide Openeye Name: N-cyclohexyl-2-[methyl(3-methylbutanoylcarbamothioyl)amino]benzamide CAS Name: N-cyclohexyl-2-[methyl-[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[methyl(3-methylbutanoylcarbamothioyl)amino]benzamide Traditional Name: N-cyclohexyl-2-[isovalerylthiocarbamoyl(methyl)amino]benzamide Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)N(C)C1=CC=CC=C1C(=O)NC2CCCCC2

Isomeric SMILES

CC(C)CC(=O)NC(=S)N(C)C1=CC=CC=C1C(=O)NC2CCCCC2

InChI

InChI=1S/C20H29N3O2S/c1-14(2)13-18(24)22-20(26)23(3)17-12-8-7-11-16(17)19(25)21-15-9-5-4-6-10-15/h7-8,11-12,14-15H,4-6,9-10,13H2,1-3H3,(H,21,25)(H,22,24,26)