N-[1-[(2-methyl-7-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]-3-phenyl-5-sulfanylidene-1,2,4-triazol-4-yl]pyridine-4-carboxamide

Systemtic Name: N-[1-[(2-methyl-7-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]-3-phenyl-5-sulfanylidene-1,2,4-triazol-4-yl]pyridine-4-carboxamide Openeye Name: N-[1-[(2-methyl-7-nitro-4-oxo-quinazolin-3-yl)methyl]-3-phenyl-5-thioxo-1,2,4-triazol-4-yl]pyridine-4-carboxamide CAS Name: N-[1-[(2-methyl-7-nitro-4-oxo-3-quinazolinyl)methyl]-3-phenyl-5-sulfanylidene-1,2,4-triazol-4-yl]-4-pyridinecarboxamide IUPAC Name: N-[1-[(2-methyl-7-nitro-4-oxoquinazolin-3-yl)methyl]-3-phenyl-5-sulfanylidene-1,2,4-triazol-4-yl]pyridine-4-carboxamide Traditional Name: N-[1-[(4-keto-2-methyl-7-nitro-quinazolin-3-yl)methyl]-3-phenyl-5-thioxo-1,2,4-triazol-4-yl]isonicotinamide Formula: C24H18N8O4S MolecularWeight: 514.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1CN3C(=S)N(C(=N3)C4=CC=CC=C4)NC(=O)C5=CC=NC=C5

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1CN3C(=S)N(C(=N3)C4=CC=CC=C4)NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C24H18N8O4S/c1-15-26-20-13-18(32(35)36)7-8-19(20)23(34)29(15)14-30-24(37)31(21(27-30)16-5-3-2-4-6-16)28-22(33)17-9-11-25-12-10-17/h2-13H,14H2,1H3,(H,28,33)