2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dimethoxy-3-(1-oxidanylbutan-2-yl)quinazolin-4-one

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dimethoxy-3-(1-oxidanylbutan-2-yl)quinazolin-4-one Openeye Name: 3-[1-(hydroxymethyl)propyl]-2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-6,7-dimethoxy-quinazolin-4-one CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-3-(1-hydroxybutan-2-yl)-6,7-dimethoxy-4-quinazolinone IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-3-(1-hydroxybutan-2-yl)-6,7-dimethoxyquinazolin-4-one Traditional Name: 2-[(2-indolin-1-yl-2-keto-ethyl)thio]-6,7-dimethoxy-3-(1-methylolpropyl)quinazolin-4-one Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N1C(=O)C2=CC(=C(C=C2N=C1SCC(=O)N3CCC4=CC=CC=C43)OC)OC

Isomeric SMILES

CCC(CO)N1C(=O)C2=CC(=C(C=C2N=C1SCC(=O)N3CCC4=CC=CC=C43)OC)OC

InChI

InChI=1S/C24H27N3O5S/c1-4-16(13-28)27-23(30)17-11-20(31-2)21(32-3)12-18(17)25-24(27)33-14-22(29)26-10-9-15-7-5-6-8-19(15)26/h5-8,11-12,16,28H,4,9-10,13-14H2,1-3H3