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

Systemtic Name: methyl 4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(4-methyl-3-nitrobenzoyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]thiazole-5-carboxylic acid methyl ester Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NC(=C(S2)C(=O)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NC(=C(S2)C(=O)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O5S/c1-7-4-5-9(6-10(7)17(20)21)12(18)16-14-15-8(2)11(23-14)13(19)22-3/h4-6H,1-3H3,(H,15,16,18)