N-(1-cyclopropylethyl)-2-[3-(6-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-cyclopropylethyl)-2-[3-(6-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-cyclopropylethyl)-2-[3-(6-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(1-cyclopropylethyl)-2-[[3-(6-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(1-cyclopropylethyl)-2-[3-(6-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(1-cyclopropylethyl)-2-[[4-keto-3-(6-methyl-2-pyridyl)quinazolin-2-yl]thio]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)C4CC4

Isomeric SMILES

CC1=NC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)C4CC4

InChI

InChI=1S/C21H22N4O2S/c1-13-6-5-9-18(22-13)25-20(27)16-7-3-4-8-17(16)24-21(25)28-12-19(26)23-14(2)15-10-11-15/h3-9,14-15H,10-12H2,1-2H3,(H,23,26)