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

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-methyl-2-nitro-phenyl)-2-[3-(5-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-[[3-(5-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-[3-(5-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(5-methyl-2-pyridyl)quinazolin-2-yl]thio]-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C23H19N5O4S MolecularWeight: 461.49306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O4S/c1-14-7-9-18(19(11-14)28(31)32)25-21(29)13-33-23-26-17-6-4-3-5-16(17)22(30)27(23)20-10-8-15(2)12-24-20/h3-12H,13H2,1-2H3,(H,25,29)