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

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[[1-[(2-nitrophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C19H17N5O7S MolecularWeight: 459.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-])C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C19H17N5O7S/c1-10-14(19(27)30-2)18(32-15(10)16(20)25)21-17(26)11-7-8-23(22-11)9-31-13-6-4-3-5-12(13)24(28)29/h3-8H,9H2,1-2H3,(H2,20,25)(H,21,26)