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

Systemtic Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]-2,4-bis(oxidanylidene)pyrimidine-5-carboxamide Openeye Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]-2,4-dioxo-pyrimidine-5-carboxamide CAS Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]-2,4-dioxo-5-pyrimidinecarboxamide IUPAC Name: 1-butyl-3-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]-2,4-dioxopyrimidine-5-carboxamide Traditional Name: 1-butyl-3-(3-chlorophenyl)-2,4-diketo-N-(4-mesylbenzyl)pyrimidine-5-carboxamide Formula: C23H24ClN3O5S MolecularWeight: 489.97176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)N(C1=O)C2=CC(=CC=C2)Cl)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCN1C=C(C(=O)N(C1=O)C2=CC(=CC=C2)Cl)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H24ClN3O5S/c1-3-4-12-26-15-20(22(29)27(23(26)30)18-7-5-6-17(24)13-18)21(28)25-14-16-8-10-19(11-9-16)33(2,31)32/h5-11,13,15H,3-4,12,14H2,1-2H3,(H,25,28)