(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: [2-(2-thienyl)thiazol-4-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid (2-thiophen-2-yl-4-thiazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid [2-(2-thienyl)thiazol-4-yl]methyl ester Formula: C14H11N3O4S2 MolecularWeight: 349.38484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=CSC(=N2)C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=CSC(=N2)C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O4S2/c1-16-6-10(17(19)20)5-11(16)14(18)21-7-9-8-23-13(15-9)12-3-2-4-22-12/h2-6,8H,7H2,1H3