8,8-dimethyl-2-pentylsulfanyl-5-pyridin-4-yl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione

Systemtic Name: 8,8-dimethyl-2-pentylsulfanyl-5-pyridin-4-yl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione Openeye Name: 8,8-dimethyl-2-pentylsulfanyl-5-(4-pyridyl)-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione CAS Name: 8,8-dimethyl-2-(pentylthio)-5-pyridin-4-yl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione IUPAC Name: 8,8-dimethyl-2-pentylsulfanyl-5-pyridin-4-yl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione Traditional Name: 2-(amylthio)-8,8-dimethyl-5-(4-pyridyl)-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-quinone Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=NC=C4)C(=O)CC(C3)(C)C

Isomeric SMILES

CCCCCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=NC=C4)C(=O)CC(C3)(C)C

InChI

InChI=1S/C23H28N4O2S/c1-4-5-6-11-30-22-26-20-19(21(29)27-22)17(14-7-9-24-10-8-14)18-15(25-20)12-23(2,3)13-16(18)28/h7-10,17H,4-6,11-13H2,1-3H3,(H2,25,26,27,29)