3-(3-chlorophenyl)-2-propan-2-ylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-one

Systemtic Name: 3-(3-chlorophenyl)-2-propan-2-ylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-one Openeye Name: 3-(3-chlorophenyl)-2-isopropylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-one CAS Name: 3-(3-chlorophenyl)-2-(propan-2-ylthio)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-one IUPAC Name: 3-(3-chlorophenyl)-2-propan-2-ylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-one Traditional Name: 3-(3-chlorophenyl)-2-(isopropylthio)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-one Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=NC3=C(CCCC3)C=C2C(=O)N1C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)SC1=NC2=NC3=C(CCCC3)C=C2C(=O)N1C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H20ClN3OS/c1-12(2)26-20-23-18-16(10-13-6-3-4-9-17(13)22-18)19(25)24(20)15-8-5-7-14(21)11-15/h5,7-8,10-12H,3-4,6,9H2,1-2H3