(9S)-2-ethylsulfanyl-9-(2-methoxyphenyl)-6,6-dimethyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one

Systemtic Name: (9S)-2-ethylsulfanyl-9-(2-methoxyphenyl)-6,6-dimethyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one Openeye Name: (9S)-2-ethylsulfanyl-9-(2-methoxyphenyl)-6,6-dimethyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one CAS Name: (9S)-2-(ethylthio)-9-(2-methoxyphenyl)-6,6-dimethyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one IUPAC Name: (9S)-2-ethylsulfanyl-9-(2-methoxyphenyl)-6,6-dimethyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one Traditional Name: (9S)-2-(ethylthio)-9-(2-methoxyphenyl)-6,6-dimethyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=NC3=C(C(N2N1)C4=CC=CC=C4OC)C(=O)CC(C3)(C)C

Isomeric SMILES

CCSC1=NC2=NC3=C([C@@H](N2N1)C4=CC=CC=C4OC)C(=O)CC(C3)(C)C

InChI

InChI=1S/C20H24N4O2S/c1-5-27-19-22-18-21-13-10-20(2,3)11-14(25)16(13)17(24(18)23-19)12-8-6-7-9-15(12)26-4/h6-9,17H,5,10-11H2,1-4H3,(H,21,22,23)/t17-/m0/s1