4-methoxy-N-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]benzamide

Systemtic Name: 4-methoxy-N-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]benzamide Openeye Name: 4-methoxy-N-[1-(m-tolylcarbamothioyl)-4-piperidyl]benzamide CAS Name: 4-methoxy-N-[1-[(3-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]benzamide IUPAC Name: 4-methoxy-N-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]benzamide Traditional Name: 4-methoxy-N-[1-(m-tolylthiocarbamoyl)-4-piperidyl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2S/c1-15-4-3-5-18(14-15)23-21(27)24-12-10-17(11-13-24)22-20(25)16-6-8-19(26-2)9-7-16/h3-9,14,17H,10-13H2,1-2H3,(H,22,25)(H,23,27)