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

Systemtic Name: 1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methoxy-phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methoxy-phenyl]urea CAS Name: 1-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-methoxyphenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methoxyphenyl]urea Traditional Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methoxy-phenyl]urea Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H28N4O3/c1-35-26-12-11-24(17-25(26)31-28(34)30-19-21-5-3-2-4-6-21)27(33)32-15-13-23(14-16-32)22-9-7-20(18-29)8-10-22/h2-12,17,23H,13-16,19H2,1H3,(H2,30,31,34)