2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(4-oxidanylidene-2-thiophen-2-yl-quinazolin-3-yl)ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(4-oxidanylidene-2-thiophen-2-yl-quinazolin-3-yl)ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-oxo-2-(2-thienyl)quinazolin-3-yl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(4-oxo-2-thiophen-2-yl-3-quinazolinyl)acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(4-oxo-2-thiophen-2-ylquinazolin-3-yl)acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-keto-2-(2-thienyl)quinazolin-3-yl]acetamide Formula: C18H13BrN6O4S MolecularWeight: 489.30262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC=CS4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC=CS4)[N+](=O)[O-])Br

InChI

InChI=1S/C18H13BrN6O4S/c1-10-15(19)17(25(28)29)22-23(10)9-14(26)21-24-16(13-7-4-8-30-13)20-12-6-3-2-5-11(12)18(24)27/h2-8H,9H2,1H3,(H,21,26)