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

Systemtic Name: 1-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-fluoranyl-phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-fluoro-phenyl]urea CAS Name: 1-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-fluorophenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-fluorophenyl]urea Traditional Name: 1-benzyl-3-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-fluoro-phenyl]urea Formula: C27H25FN4O2 MolecularWeight: 456.511403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=C(C=C2)C#N)C(=O)C3=CC(=C(C=C3)F)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=CC=C(C=C2)C#N)C(=O)C3=CC(=C(C=C3)F)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H25FN4O2/c28-24-11-10-23(16-25(24)31-27(34)30-18-20-4-2-1-3-5-20)26(33)32-14-12-22(13-15-32)21-8-6-19(17-29)7-9-21/h1-11,16,22H,12-15,18H2,(H2,30,31,34)