N-(2-methyl-6-nitro-phenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-methyl-6-nitro-phenyl)-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(2-methyl-6-nitrophenyl)-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(2-methyl-6-nitrophenyl)-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-keto-3-propyl-quinazolin-2-yl)thio]-N-(2-methyl-6-nitro-phenyl)acetamide Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O4S/c1-3-11-23-19(26)14-8-4-5-9-15(14)21-20(23)29-12-17(25)22-18-13(2)7-6-10-16(18)24(27)28/h4-10H,3,11-12H2,1-2H3,(H,22,25)