1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-(2-pyridin-3-ylethyl)urea

Systemtic Name: 1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-(2-pyridin-3-ylethyl)urea Openeye Name: 1-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-[2-(3-pyridyl)ethyl]urea CAS Name: 1-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-methylphenyl]-3-[2-(3-pyridinyl)ethyl]urea IUPAC Name: 1-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methylphenyl]-3-(2-pyridin-3-ylethyl)urea Traditional Name: 1-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-[2-(3-pyridyl)ethyl]urea Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NCCC4=CN=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NCCC4=CN=CC=C4

InChI

InChI=1S/C28H29N5O2/c1-20-4-7-25(17-26(20)32-28(35)31-14-10-22-3-2-13-30-19-22)27(34)33-15-11-24(12-16-33)23-8-5-21(18-29)6-9-23/h2-9,13,17,19,24H,10-12,14-16H2,1H3,(H2,31,32,35)