N-[1-[(4-ethylphenyl)carbamothioyl]piperidin-4-yl]-3-methyl-benzamide

Systemtic Name: N-[1-[(4-ethylphenyl)carbamothioyl]piperidin-4-yl]-3-methyl-benzamide Openeye Name: N-[1-[(4-ethylphenyl)carbamothioyl]-4-piperidyl]-3-methyl-benzamide CAS Name: N-[1-[(4-ethylanilino)-sulfanylidenemethyl]-4-piperidinyl]-3-methylbenzamide IUPAC Name: N-[1-[(4-ethylphenyl)carbamothioyl]piperidin-4-yl]-3-methylbenzamide Traditional Name: N-[1-[(4-ethylphenyl)thiocarbamoyl]-4-piperidyl]-3-methyl-benzamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N2CCC(CC2)NC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N2CCC(CC2)NC(=O)C3=CC(=CC=C3)C

InChI

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