3-methyl-2-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanyl-benzo[g]quinazolin-4-one

Systemtic Name: 3-methyl-2-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanyl-benzo[g]quinazolin-4-one Openeye Name: 3-methyl-2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanyl-benzo[g]quinazolin-4-one CAS Name: 3-methyl-2-[[2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl]thio]-4-benzo[g]quinazolinone IUPAC Name: 3-methyl-2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylbenzo[g]quinazolin-4-one Traditional Name: 2-[[2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]thio]-3-methyl-benzo[g]quinazolin-4-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

InChI

InChI=1S/C22H21N3O2S/c1-13-9-17(14(2)24(13)3)20(26)12-28-22-23-19-11-16-8-6-5-7-15(16)10-18(19)21(27)25(22)4/h5-11H,12H2,1-4H3