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

Systemtic Name: 2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]ethanamide Openeye Name: 2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]acetamide CAS Name: 2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]acetamide Traditional Name: 2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]acetamide Formula: C28H25N5O2S MolecularWeight: 495.5954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C28H25N5O2S/c1-20-7-11-23(12-8-20)33-27(35)24-5-2-3-6-25(24)31-28(33)36-19-26(34)29-17-15-21-9-13-22(14-10-21)32-18-4-16-30-32/h2-14,16,18H,15,17,19H2,1H3,(H,29,34)