1-butyl-N-[(4-cyanocyclohexyl)methyl]-3-(3-cyanophenyl)-2,4-bis(oxidanylidene)pyrimidine-5-carboxamide

Systemtic Name: 1-butyl-N-[(4-cyanocyclohexyl)methyl]-3-(3-cyanophenyl)-2,4-bis(oxidanylidene)pyrimidine-5-carboxamide Openeye Name: 1-butyl-N-[(4-cyanocyclohexyl)methyl]-3-(3-cyanophenyl)-2,4-dioxo-pyrimidine-5-carboxamide CAS Name: 1-butyl-N-[(4-cyanocyclohexyl)methyl]-3-(3-cyanophenyl)-2,4-dioxo-5-pyrimidinecarboxamide IUPAC Name: 1-butyl-N-[(4-cyanocyclohexyl)methyl]-3-(3-cyanophenyl)-2,4-dioxopyrimidine-5-carboxamide Traditional Name: 1-butyl-N-[(4-cyanocyclohexyl)methyl]-3-(3-cyanophenyl)-2,4-diketo-pyrimidine-5-carboxamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)N(C1=O)C2=CC=CC(=C2)C#N)C(=O)NCC3CCC(CC3)C#N

Isomeric SMILES

CCCCN1C=C(C(=O)N(C1=O)C2=CC=CC(=C2)C#N)C(=O)NCC3CCC(CC3)C#N

InChI

InChI=1S/C24H27N5O3/c1-2-3-11-28-16-21(22(30)27-15-18-9-7-17(13-25)8-10-18)23(31)29(24(28)32)20-6-4-5-19(12-20)14-26/h4-6,12,16-18H,2-3,7-11,15H2,1H3,(H,27,30)