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

Systemtic Name: 2-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-methylphenyl)quinazolin-4-one Openeye Name: 2-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-3-(p-tolyl)quinazolin-4-one CAS Name: 2-[[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]thio]-3-(4-methylphenyl)-4-quinazolinone IUPAC Name: 2-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-3-(4-methylphenyl)quinazolin-4-one Traditional Name: 2-[[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl]thio]-3-(p-tolyl)quinazolin-4-one Formula: C27H23N3O2S MolecularWeight: 453.55542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C

InChI

InChI=1S/C27H23N3O2S/c1-3-18-7-6-9-20-22(15-28-25(18)20)24(31)16-33-27-29-23-10-5-4-8-21(23)26(32)30(27)19-13-11-17(2)12-14-19/h4-15,28H,3,16H2,1-2H3