1-[2-[[3-[(3-chlorophenyl)methyl]piperidin-1-yl]methyl]-3-methyl-phenyl]-3-methyl-urea

Systemtic Name: 1-[2-[[3-[(3-chlorophenyl)methyl]piperidin-1-yl]methyl]-3-methyl-phenyl]-3-methyl-urea Openeye Name: 1-[2-[[3-[(3-chlorophenyl)methyl]-1-piperidyl]methyl]-3-methyl-phenyl]-3-methyl-urea CAS Name: 1-[2-[[3-[(3-chlorophenyl)methyl]-1-piperidinyl]methyl]-3-methylphenyl]-3-methylurea IUPAC Name: 1-[2-[[3-[(3-chlorophenyl)methyl]piperidin-1-yl]methyl]-3-methylphenyl]-3-methylurea Traditional Name: 1-[2-[[3-(3-chlorobenzyl)piperidino]methyl]-3-methyl-phenyl]-3-methyl-urea Formula: C22H28ClN3O MolecularWeight: 385.93022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)NC)CN2CCCC(C2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)NC)CN2CCCC(C2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H28ClN3O/c1-16-6-3-10-21(25-22(27)24-2)20(16)15-26-11-5-8-18(14-26)12-17-7-4-9-19(23)13-17/h3-4,6-7,9-10,13,18H,5,8,11-12,14-15H2,1-2H3,(H2,24,25,27)