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

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]acetamide Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C27H24N4O2S/c1-18-10-12-20(13-11-18)31-26(33)22-7-3-5-9-24(22)30-27(31)34-17-25(32)28-15-14-19-16-29-23-8-4-2-6-21(19)23/h2-13,16,29H,14-15,17H2,1H3,(H,28,32)