N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]-2-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]-2-[[4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]-N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]acetamide Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

InChI

InChI=1S/C26H27N5O3S/c1-17-9-11-19(12-10-17)31-23(14-18(2)29-31)28-24(32)16-35-26-27-22-8-4-3-7-21(22)25(33)30(26)15-20-6-5-13-34-20/h3-4,7-12,14,20H,5-6,13,15-16H2,1-2H3,(H,28,32)