1-[(6-methylpyridin-2-yl)methyl]-3-(4-methylsulfanylphenyl)-1-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 1-[(6-methylpyridin-2-yl)methyl]-3-(4-methylsulfanylphenyl)-1-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-(1-benzyl-4-piperidyl)-1-[(6-methyl-2-pyridyl)methyl]-3-(4-methylsulfanylphenyl)urea CAS Name: 1-[(6-methyl-2-pyridinyl)methyl]-3-[4-(methylthio)phenyl]-1-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-1-[(6-methylpyridin-2-yl)methyl]-3-(4-methylsulfanylphenyl)urea Traditional Name: 1-(1-benzyl-4-piperidyl)-1-[(6-methyl-2-pyridyl)methyl]-3-[4-(methylthio)phenyl]urea Formula: C27H32N4OS MolecularWeight: 460.63418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN(C2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=NC(=CC=C1)CN(C2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C27H32N4OS/c1-21-7-6-10-24(28-21)20-31(27(32)29-23-11-13-26(33-2)14-12-23)25-15-17-30(18-16-25)19-22-8-4-3-5-9-22/h3-14,25H,15-20H2,1-2H3,(H,29,32)