N-cyclopentyl-2-[3-(3-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCC4

Isomeric SMILES

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCC4

InChI

InChI=1S/C21H22N4O2S/c1-14-7-6-12-22-19(14)25-20(27)16-10-4-5-11-17(16)24-21(25)28-13-18(26)23-15-8-2-3-9-15/h4-7,10-12,15H,2-3,8-9,13H2,1H3,(H,23,26)