N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-5-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-5-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-5-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C22H28N6O3 MolecularWeight: 424.49612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C22H28N6O3/c1-4-6-13-26(18-19(23)27(12-5-2)22(31)25-20(18)29)21(30)17-14-24-28(15(17)3)16-10-8-7-9-11-16/h7-11,14H,4-6,12-13,23H2,1-3H3,(H,25,29,31)