1-(3-ethylphenyl)-3-[4-(4-methylpiperidin-1-yl)-3-piperidin-1-ylcarbonyl-phenyl]urea

Systemtic Name: 1-(3-ethylphenyl)-3-[4-(4-methylpiperidin-1-yl)-3-piperidin-1-ylcarbonyl-phenyl]urea Openeye Name: 1-(3-ethylphenyl)-3-[4-(4-methyl-1-piperidyl)-3-(piperidine-1-carbonyl)phenyl]urea CAS Name: 1-(3-ethylphenyl)-3-[4-(4-methyl-1-piperidinyl)-3-[oxo(1-piperidinyl)methyl]phenyl]urea IUPAC Name: 1-(3-ethylphenyl)-3-[4-(4-methylpiperidin-1-yl)-3-(piperidine-1-carbonyl)phenyl]urea Traditional Name: 1-(3-ethylphenyl)-3-[4-(4-methylpiperidino)-3-(piperidine-1-carbonyl)phenyl]urea Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC(CC3)C)C(=O)N4CCCCC4

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC(CC3)C)C(=O)N4CCCCC4

InChI

InChI=1S/C27H36N4O2/c1-3-21-8-7-9-22(18-21)28-27(33)29-23-10-11-25(30-16-12-20(2)13-17-30)24(19-23)26(32)31-14-5-4-6-15-31/h7-11,18-20H,3-6,12-17H2,1-2H3,(H2,28,29,33)