1-[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxidanylidene-pyridin-3-yl]-3-(phenylmethyl)urea

Systemtic Name: 1-[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxidanylidene-pyridin-3-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxo-3-pyridyl]urea CAS Name: 1-[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxo-3-pyridinyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxopyridin-3-yl]urea Traditional Name: 1-benzyl-3-[6-butyl-1-[4-(2-cyanophenyl)benzyl]-2-keto-3-pyridyl]urea Formula: C31H30N4O2 MolecularWeight: 490.5955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C31H30N4O2/c1-2-3-12-27-18-19-29(34-31(37)33-21-23-9-5-4-6-10-23)30(36)35(27)22-24-14-16-25(17-15-24)28-13-8-7-11-26(28)20-32/h4-11,13-19H,2-3,12,21-22H2,1H3,(H2,33,34,37)