1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2,4-dimethyl-phenyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2,4-dimethyl-phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2,4-dimethyl-phenyl]urea CAS Name: 1-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2,4-dimethylphenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2,4-dimethylphenyl]urea Traditional Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2,4-dimethyl-phenyl]urea Formula: C29H30N4O2 MolecularWeight: 466.5741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C29H30N4O2/c1-20-16-21(2)27(32-29(35)31-19-23-6-4-3-5-7-23)17-26(20)28(34)33-14-12-25(13-15-33)24-10-8-22(18-30)9-11-24/h3-11,16-17,25H,12-15,19H2,1-2H3,(H2,31,32,35)