1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-[4-(1,1-dimethylbutylsulfanyl)phenyl]-1-methyl-urea CAS Name: 1-methyl-3-[4-(2-methylpentan-2-ylthio)phenyl]-1-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]urea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-[4-(1,1-dimethylbutylthio)phenyl]-1-methyl-urea Formula: C26H37N3OS MolecularWeight: 439.65648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)N(C)C2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)N(C)C2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C26H37N3OS/c1-5-17-26(2,3)31-24-13-11-22(12-14-24)27-25(30)28(4)23-15-18-29(19-16-23)20-21-9-7-6-8-10-21/h6-14,23H,5,15-20H2,1-4H3,(H,27,30)