2-[1-(1-ethanoyl-2,3-dihydroindol-5-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-[(4-methylphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[1-(1-ethanoyl-2,3-dihydroindol-5-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-[(4-methylphenyl)methyl]quinazolin-4-one Openeye Name: 2-[2-(1-acetylindolin-5-yl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(p-tolylmethyl)quinazolin-4-one CAS Name: 2-[[1-(1-acetyl-2,3-dihydroindol-5-yl)-1-oxopropan-2-yl]thio]-3-[(4-methylphenyl)methyl]-4-quinazolinone IUPAC Name: 2-[1-(1-acetyl-2,3-dihydroindol-5-yl)-1-oxopropan-2-yl]sulfanyl-3-[(4-methylphenyl)methyl]quinazolin-4-one Traditional Name: 2-[[2-(1-acetylindolin-5-yl)-2-keto-1-methyl-ethyl]thio]-3-(4-methylbenzyl)quinazolin-4-one Formula: C29H27N3O3S MolecularWeight: 497.60798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C4=CC5=C(C=C4)N(CC5)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)C4=CC5=C(C=C4)N(CC5)C(=O)C

InChI

InChI=1S/C29H27N3O3S/c1-18-8-10-21(11-9-18)17-32-28(35)24-6-4-5-7-25(24)30-29(32)36-19(2)27(34)23-12-13-26-22(16-23)14-15-31(26)20(3)33/h4-13,16,19H,14-15,17H2,1-3H3