N-(4-oxidanylidene-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)-2-propylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(4-oxidanylidene-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)-2-propylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(4-oxo-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)-2-propylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-oxo-2-(4-pyrimidinyl)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl]-2-(propylthio)-3-pyridinecarboxamide IUPAC Name: N-(4-oxo-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)-2-propylsulfanylpyridine-3-carboxamide Traditional Name: N-[4-keto-2-(4-pyrimidyl)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl]-2-(propylthio)nicotinamide Formula: C21H22N6O2S MolecularWeight: 422.50338

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC=N1)C(=O)NC2CCCN3C2=NC(=CC3=O)C4=NC=NC=C4

Isomeric SMILES

CCCSC1=C(C=CC=N1)C(=O)NC2CCCN3C2=NC(=CC3=O)C4=NC=NC=C4

InChI

InChI=1S/C21H22N6O2S/c1-2-11-30-21-14(5-3-8-23-21)20(29)26-16-6-4-10-27-18(28)12-17(25-19(16)27)15-7-9-22-13-24-15/h3,5,7-9,12-13,16H,2,4,6,10-11H2,1H3,(H,26,29)