N-(2-methoxy-4-nitro-phenyl)-2-[[2-(3-nitrophenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-2-[[2-(3-nitrophenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-2-[[2-(3-nitrobenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-methoxy-4-nitrophenyl)-2-[[2-[(3-nitrophenyl)-oxomethyl]-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-2-[[2-(3-nitrobenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-2-[[2-(3-nitrobenzoyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C24H18N6O7S MolecularWeight: 534.50072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NN2C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NN2C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H18N6O7S/c1-37-20-13-18(30(35)36)10-11-19(20)25-21(31)14-38-24-26-22(15-6-3-2-4-7-15)27-28(24)23(32)16-8-5-9-17(12-16)29(33)34/h2-13H,14H2,1H3,(H,25,31)