N-cyclohexyl-N-methyl-2-(3-methylbutanoylcarbamothioylamino)benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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