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

Systemtic Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-cyanocyclohexyl)methyl]-2,4-bis(oxidanylidene)pyrimidine-5-carboxamide Openeye Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-cyanocyclohexyl)methyl]-2,4-dioxo-pyrimidine-5-carboxamide CAS Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-cyanocyclohexyl)methyl]-2,4-dioxo-5-pyrimidinecarboxamide IUPAC Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-cyanocyclohexyl)methyl]-2,4-dioxopyrimidine-5-carboxamide Traditional Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-cyanocyclohexyl)methyl]-2,4-diketo-pyrimidine-5-carboxamide Formula: C23H27ClN4O3 MolecularWeight: 442.93848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClN4O3/c1-2-3-11-27-15-20(21(29)26-14-17-9-7-16(13-25)8-10-17)22(30)28(23(27)31)19-6-4-5-18(24)12-19/h4-6,12,15-17H,2-3,7-11,14H2,1H3,(H,26,29)