N-[1-[(3,4-dimethylphenyl)carbamothioyl]piperidin-4-yl]cyclohexanecarboxamide

Systemtic Name: N-[1-[(3,4-dimethylphenyl)carbamothioyl]piperidin-4-yl]cyclohexanecarboxamide Openeye Name: N-[1-[(3,4-dimethylphenyl)carbamothioyl]-4-piperidyl]cyclohexanecarboxamide CAS Name: N-[1-[(3,4-dimethylanilino)-sulfanylidenemethyl]-4-piperidinyl]cyclohexanecarboxamide IUPAC Name: N-[1-[(3,4-dimethylphenyl)carbamothioyl]piperidin-4-yl]cyclohexanecarboxamide Traditional Name: N-[1-[(3,4-dimethylphenyl)thiocarbamoyl]-4-piperidyl]cyclohexanecarboxamide Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCC(CC2)NC(=O)C3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCC(CC2)NC(=O)C3CCCCC3)C

InChI

InChI=1S/C21H31N3OS/c1-15-8-9-19(14-16(15)2)23-21(26)24-12-10-18(11-13-24)22-20(25)17-6-4-3-5-7-17/h8-9,14,17-18H,3-7,10-13H2,1-2H3,(H,22,25)(H,23,26)