(5R,5aS)-2-propylsulfanyl-5-pyridin-4-yl-1,5,5a,7,8,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione

Systemtic Name: (5R,5aS)-2-propylsulfanyl-5-pyridin-4-yl-1,5,5a,7,8,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione Openeye Name: (5R,5aS)-2-propylsulfanyl-5-(4-pyridyl)-1,5,5a,7,8,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione CAS Name: (5R,5aS)-2-(propylthio)-5-pyridin-4-yl-1,5,5a,7,8,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione IUPAC Name: (5R,5aS)-2-propylsulfanyl-5-pyridin-4-yl-1,5,5a,7,8,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione Traditional Name: (5R,5aS)-2-(propylthio)-5-(4-pyridyl)-1,5,5a,7,8,10-hexahydropyrimido[4,5-b]quinoline-4,6-quinone Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=O)C2=C(N1)NC3=CCCC(=O)C3C2C4=CC=NC=C4

Isomeric SMILES

CCCSC1=NC(=O)C2=C(N1)NC3=CCCC(=O)[C@H]3[C@@H]2C4=CC=NC=C4

InChI

InChI=1S/C19H20N4O2S/c1-2-10-26-19-22-17-16(18(25)23-19)14(11-6-8-20-9-7-11)15-12(21-17)4-3-5-13(15)24/h4,6-9,14-15H,2-3,5,10H2,1H3,(H2,21,22,23,25)/t14-,15-/m0/s1