N-[1-[(3,5-dimethylphenyl)carbamothioyl]piperidin-4-yl]-4-methoxy-benzamide

Systemtic Name: N-[1-[(3,5-dimethylphenyl)carbamothioyl]piperidin-4-yl]-4-methoxy-benzamide Openeye Name: N-[1-[(3,5-dimethylphenyl)carbamothioyl]-4-piperidyl]-4-methoxy-benzamide CAS Name: N-[1-[(3,5-dimethylanilino)-sulfanylidenemethyl]-4-piperidinyl]-4-methoxybenzamide IUPAC Name: N-[1-[(3,5-dimethylphenyl)carbamothioyl]piperidin-4-yl]-4-methoxybenzamide Traditional Name: N-[1-[(3,5-dimethylphenyl)thiocarbamoyl]-4-piperidyl]-4-methoxy-benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H27N3O2S/c1-15-12-16(2)14-19(13-15)24-22(28)25-10-8-18(9-11-25)23-21(26)17-4-6-20(27-3)7-5-17/h4-7,12-14,18H,8-11H2,1-3H3,(H,23,26)(H,24,28)