N-[1-[(2,5-dimethylphenyl)carbamothioyl]piperidin-4-yl]-4-methyl-benzamide

Systemtic Name: N-[1-[(2,5-dimethylphenyl)carbamothioyl]piperidin-4-yl]-4-methyl-benzamide Openeye Name: N-[1-[(2,5-dimethylphenyl)carbamothioyl]-4-piperidyl]-4-methyl-benzamide CAS Name: N-[1-[(2,5-dimethylanilino)-sulfanylidenemethyl]-4-piperidinyl]-4-methylbenzamide IUPAC Name: N-[1-[(2,5-dimethylphenyl)carbamothioyl]piperidin-4-yl]-4-methylbenzamide Traditional Name: N-[1-[(2,5-dimethylphenyl)thiocarbamoyl]-4-piperidyl]-4-methyl-benzamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=C(C=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H27N3OS/c1-15-5-8-18(9-6-15)21(26)23-19-10-12-25(13-11-19)22(27)24-20-14-16(2)4-7-17(20)3/h4-9,14,19H,10-13H2,1-3H3,(H,23,26)(H,24,27)