3-(3-chlorophenyl)-2-(1-phenylethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(3-chlorophenyl)-2-(1-phenylethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(3-chlorophenyl)-2-(1-phenylethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-(3-chlorophenyl)-2-(1-phenylethylthio)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(3-chlorophenyl)-2-(1-phenylethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(3-chlorophenyl)-2-(1-phenylethylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C24H18ClN3OS MolecularWeight: 431.93722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NC3=C(C(=O)N2C4=CC(=CC=C4)Cl)NC5=CC=CC=C53

Isomeric SMILES

CC(C1=CC=CC=C1)SC2=NC3=C(C(=O)N2C4=CC(=CC=C4)Cl)NC5=CC=CC=C53

InChI

InChI=1S/C24H18ClN3OS/c1-15(16-8-3-2-4-9-16)30-24-27-21-19-12-5-6-13-20(19)26-22(21)23(29)28(24)18-11-7-10-17(25)14-18/h2-15,26H,1H3