methyl 4-methyl-2-[(3-nitrophenyl)carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-methyl-2-[(3-nitrophenyl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-methyl-2-[(3-nitrobenzoyl)amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[(3-nitrophenyl)-oxomethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(3-nitrobenzoyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[(3-nitrobenzoyl)amino]thiazole-5-carboxylic acid methyl ester Formula: C13H11N3O5S MolecularWeight: 321.30854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H11N3O5S/c1-7-10(12(18)21-2)22-13(14-7)15-11(17)8-4-3-5-9(6-8)16(19)20/h3-6H,1-2H3,(H,14,15,17)