methyl 5-aminocarbonyl-4-methyl-2-[[1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[[1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[[1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[[1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-3-pyrazolyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[[1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C15H14N8O6S MolecularWeight: 434.38666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-])C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C15H14N8O6S/c1-7-9(14(26)29-2)13(30-10(7)11(16)24)18-12(25)8-3-4-21(19-8)6-22-5-17-15(20-22)23(27)28/h3-5H,6H2,1-2H3,(H2,16,24)(H,18,25)