4-[3-(3-methylbutanoylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-7-yl]carbonyl-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-(3-methylbutanoylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-7-yl]carbonyl-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[3-(3-methylbutanoylamino)-4-oxo-pyrido[1,2-a]pyrimidine-7-carbonyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[[3-[(3-methyl-1-oxobutyl)amino]-4-oxo-7-pyrido[1,2-a]pyrimidinyl]-oxomethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[3-(3-methylbutanoylamino)-4-oxopyrido[1,2-a]pyrimidine-7-carbonyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[3-(isovalerylamino)-4-keto-pyrido[1,2-a]pyrimidine-7-carbonyl]-N-phenyl-piperazine-1-carboxamide Formula: C25H28N6O4 MolecularWeight: 476.52762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CN=C2C=CC(=CN2C1=O)C(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)NC1=CN=C2C=CC(=CN2C1=O)C(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H28N6O4/c1-17(2)14-22(32)28-20-15-26-21-9-8-18(16-31(21)24(20)34)23(33)29-10-12-30(13-11-29)25(35)27-19-6-4-3-5-7-19/h3-9,15-17H,10-14H2,1-2H3,(H,27,35)(H,28,32)