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

Systemtic Name: 3-(3-chlorophenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(3-chlorophenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-(3-chlorophenyl)-2-(phenacylthio)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(3-chlorophenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(3-chlorophenyl)-2-(phenacylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C24H16ClN3O2S MolecularWeight: 445.92074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC=C4)Cl)NC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC=C4)Cl)NC5=CC=CC=C53

InChI

InChI=1S/C24H16ClN3O2S/c25-16-9-6-10-17(13-16)28-23(30)22-21(18-11-4-5-12-19(18)26-22)27-24(28)31-14-20(29)15-7-2-1-3-8-15/h1-13,26H,14H2