4-methyl-N-[1-[(2-methylphenyl)carbamothioyl]piperidin-4-yl]benzamide

Systemtic Name: 4-methyl-N-[1-[(2-methylphenyl)carbamothioyl]piperidin-4-yl]benzamide Openeye Name: 4-methyl-N-[1-(o-tolylcarbamothioyl)-4-piperidyl]benzamide CAS Name: 4-methyl-N-[1-[(2-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]benzamide IUPAC Name: 4-methyl-N-[1-[(2-methylphenyl)carbamothioyl]piperidin-4-yl]benzamide Traditional Name: 4-methyl-N-[1-(o-tolylthiocarbamoyl)-4-piperidyl]benzamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=CC=CC=C3C

InChI

InChI=1S/C21H25N3OS/c1-15-7-9-17(10-8-15)20(25)22-18-11-13-24(14-12-18)21(26)23-19-6-4-3-5-16(19)2/h3-10,18H,11-14H2,1-2H3,(H,22,25)(H,23,26)