2-methyl-N-[3-[1-[3-[(4-methylphenyl)carbamothioylamino]-3-phenyl-propyl]piperidin-4-yl]phenyl]propanamide

Systemtic Name: 2-methyl-N-[3-[1-[3-[(4-methylphenyl)carbamothioylamino]-3-phenyl-propyl]piperidin-4-yl]phenyl]propanamide Openeye Name: 2-methyl-N-[3-[1-[3-phenyl-3-(p-tolylcarbamothioylamino)propyl]-4-piperidyl]phenyl]propanamide CAS Name: 2-methyl-N-[3-[1-[3-[[(4-methylanilino)-sulfanylidenemethyl]amino]-3-phenylpropyl]-4-piperidinyl]phenyl]propanamide IUPAC Name: 2-methyl-N-[3-[1-[3-[(4-methylphenyl)carbamothioylamino]-3-phenylpropyl]piperidin-4-yl]phenyl]propanamide Traditional Name: 2-methyl-N-[3-[1-[3-phenyl-3-(p-tolylthiocarbamoylamino)propyl]-4-piperidyl]phenyl]propionamide Formula: C32H40N4OS MolecularWeight: 528.7512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC(CCN2CCC(CC2)C3=CC(=CC=C3)NC(=O)C(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC(CCN2CCC(CC2)C3=CC(=CC=C3)NC(=O)C(C)C)C4=CC=CC=C4

InChI

InChI=1S/C32H40N4OS/c1-23(2)31(37)33-29-11-7-10-27(22-29)25-16-19-36(20-17-25)21-18-30(26-8-5-4-6-9-26)35-32(38)34-28-14-12-24(3)13-15-28/h4-15,22-23,25,30H,16-21H2,1-3H3,(H,33,37)(H2,34,35,38)