7-chloranyl-3-(2-methylphenyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methylphenyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-3-(o-tolyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-(2-methylphenyl)-2-[[2-oxo-2-(1H-pyrrol-2-yl)ethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methylphenyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanylquinazolin-4-one Traditional Name: 7-chloro-2-[[2-keto-2-(1H-pyrrol-2-yl)ethyl]thio]-3-(o-tolyl)quinazolin-4-one Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)C4=CC=CN4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)C4=CC=CN4

InChI

InChI=1S/C21H16ClN3O2S/c1-13-5-2-3-7-18(13)25-20(27)15-9-8-14(22)11-17(15)24-21(25)28-12-19(26)16-6-4-10-23-16/h2-11,23H,12H2,1H3