(5S)-4-azanyl-2-ethylsulfanyl-8,8-dimethyl-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one

Systemtic Name: (5S)-4-azanyl-2-ethylsulfanyl-8,8-dimethyl-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Openeye Name: (5S)-4-amino-2-ethylsulfanyl-8,8-dimethyl-5-(4-pyridyl)-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one CAS Name: (5S)-4-amino-2-(ethylthio)-8,8-dimethyl-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one IUPAC Name: (5S)-4-amino-2-ethylsulfanyl-8,8-dimethyl-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Traditional Name: (5S)-4-amino-2-(ethylthio)-8,8-dimethyl-5-(4-pyridyl)-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC=NC=C4)C(=N1)N

Isomeric SMILES

CCSC1=NC2=C([C@@H](C3=C(N2)CC(CC3=O)(C)C)C4=CC=NC=C4)C(=N1)N

InChI

InChI=1S/C20H23N5OS/c1-4-27-19-24-17(21)16-14(11-5-7-22-8-6-11)15-12(23-18(16)25-19)9-20(2,3)10-13(15)26/h5-8,14H,4,9-10H2,1-3H3,(H3,21,23,24,25)/t14-/m1/s1