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

Systemtic Name: (2-pyridin-2-yl-1,3-thiazol-4-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: [2-(2-pyridyl)thiazol-4-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid [2-(2-pyridinyl)-4-thiazolyl]methyl ester IUPAC Name: (2-pyridin-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-pyridyl)thiazol-4-yl]methyl ester Formula: C15H12N4O4S MolecularWeight: 344.34518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=CSC(=N2)C3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=CSC(=N2)C3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O4S/c1-18-7-11(19(21)22)6-13(18)15(20)23-8-10-9-24-14(17-10)12-4-2-3-5-16-12/h2-7,9H,8H2,1H3