N-(2,3-dimethyl-6-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(2,3-dimethyl-6-nitrophenyl)-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(2,3-dimethyl-6-nitrophenyl)-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NC3=CC=CC=C32)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NC3=CC=CC=C32)C)C

InChI

InChI=1S/C19H18N4O3S/c1-11-8-9-16(23(25)26)18(12(11)2)22-17(24)10-27-19-14-6-4-5-7-15(14)20-13(3)21-19/h4-9H,10H2,1-3H3,(H,22,24)