3-(3,5-dimethylphenyl)-2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C26H21N3O2S MolecularWeight: 439.52884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CNC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CNC5=CC=CC=C54)C

InChI

InChI=1S/C26H21N3O2S/c1-16-11-17(2)13-18(12-16)29-25(31)20-8-4-6-10-23(20)28-26(29)32-15-24(30)21-14-27-22-9-5-3-7-19(21)22/h3-14,27H,15H2,1-2H3