1-(4-methyl-3-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(4-methyl-3-nitro-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(4-methyl-3-nitrophenyl)-2-[(2-methyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(4-methyl-3-nitrophenyl)-2-(2-methylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(4-methyl-3-nitro-phenyl)-2-[(2-methylquinazolin-4-yl)thio]ethanone Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O3S/c1-11-7-8-13(9-16(11)21(23)24)17(22)10-25-18-14-5-3-4-6-15(14)19-12(2)20-18/h3-9H,10H2,1-2H3