2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[3-(5-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[[3-(5-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[3-(5-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[[4-keto-3-(5-methyl-2-pyridyl)quinazolin-2-yl]thio]-N-(2-nitrophenyl)acetamide Formula: C22H17N5O4S MolecularWeight: 447.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O4S/c1-14-10-11-19(23-12-14)26-21(29)15-6-2-3-7-16(15)25-22(26)32-13-20(28)24-17-8-4-5-9-18(17)27(30)31/h2-12H,13H2,1H3,(H,24,28)