methyl 5-tert-butyl-3-[(2-nitrophenyl)carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[(2-nitrophenyl)carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[(2-nitrophenyl)carbamoylamino]thiophene-2-carboxylate CAS Name: 5-tert-butyl-3-[[(2-nitroanilino)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[(2-nitrophenyl)carbamoylamino]thiophene-2-carboxylate Traditional Name: 5-tert-butyl-3-[(2-nitrophenyl)carbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S/c1-17(2,3)13-9-11(14(26-13)15(21)25-4)19-16(22)18-10-7-5-6-8-12(10)20(23)24/h5-9H,1-4H3,(H2,18,19,22)