N-[[4-(2-methylpropanoylamino)cyclohexyl]methylcarbamothioyl]benzamide

Systemtic Name: N-[[4-(2-methylpropanoylamino)cyclohexyl]methylcarbamothioyl]benzamide Openeye Name: N-[[4-(2-methylpropanoylamino)cyclohexyl]methylcarbamothioyl]benzamide CAS Name: N-[[[4-[(2-methyl-1-oxopropyl)amino]cyclohexyl]methylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(2-methylpropanoylamino)cyclohexyl]methylcarbamothioyl]benzamide Traditional Name: N-[[4-(isobutyrylamino)cyclohexyl]methylthiocarbamoyl]benzamide Formula: C19H27N3O2S MolecularWeight: 361.50158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1CCC(CC1)CNC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC1CCC(CC1)CNC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H27N3O2S/c1-13(2)17(23)21-16-10-8-14(9-11-16)12-20-19(25)22-18(24)15-6-4-3-5-7-15/h3-7,13-14,16H,8-12H2,1-2H3,(H,21,23)(H2,20,22,24,25)