N-[(4-fluorophenyl)methyl]-3-(3-methylbutanoylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidine-7-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-(3-methylbutanoylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidine-7-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-(3-methylbutanoylamino)-4-oxo-pyrido[1,2-a]pyrimidine-7-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-3-[(3-methyl-1-oxobutyl)amino]-4-oxo-7-pyrido[1,2-a]pyrimidinecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-(3-methylbutanoylamino)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide Traditional Name: N-(4-fluorobenzyl)-3-(isovalerylamino)-4-keto-pyrido[1,2-a]pyrimidine-7-carboxamide Formula: C21H21FN4O3 MolecularWeight: 396.414843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CN=C2C=CC(=CN2C1=O)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CC(=O)NC1=CN=C2C=CC(=CN2C1=O)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O3/c1-13(2)9-19(27)25-17-11-23-18-8-5-15(12-26(18)21(17)29)20(28)24-10-14-3-6-16(22)7-4-14/h3-8,11-13H,9-10H2,1-2H3,(H,24,28)(H,25,27)