N-[[2-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[2-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[2-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[2-[(4-methyl-1-piperidinyl)-oxomethyl]anilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[2-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[2-(4-methylpiperidine-1-carbonyl)phenyl]thiocarbamoyl]cyclohexanecarboxamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3CCCCC3

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3CCCCC3

InChI

InChI=1S/C21H29N3O2S/c1-15-11-13-24(14-12-15)20(26)17-9-5-6-10-18(17)22-21(27)23-19(25)16-7-3-2-4-8-16/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3,(H2,22,23,25,27)