1-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-3-(3-methylsulfanylphenyl)urea

Systemtic Name: 1-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-3-(3-methylsulfanylphenyl)urea Openeye Name: 1-(3-methylsulfanylphenyl)-3-[[1-(o-tolylmethyl)-4-piperidyl]methyl]urea CAS Name: 1-[[1-[(2-methylphenyl)methyl]-4-piperidinyl]methyl]-3-[3-(methylthio)phenyl]urea IUPAC Name: 1-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-3-(3-methylsulfanylphenyl)urea Traditional Name: 1-[[1-(2-methylbenzyl)-4-piperidyl]methyl]-3-[3-(methylthio)phenyl]urea Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCC(CC2)CNC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC1=CC=CC=C1CN2CCC(CC2)CNC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C22H29N3OS/c1-17-6-3-4-7-19(17)16-25-12-10-18(11-13-25)15-23-22(26)24-20-8-5-9-21(14-20)27-2/h3-9,14,18H,10-13,15-16H2,1-2H3,(H2,23,24,26)