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

Systemtic Name: methyl 4-methyl-2-[2-(4-nitrophenyl)ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-(4-nitrophenyl)-1-oxoethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H13N3O5S/c1-8-12(13(19)22-2)23-14(15-8)16-11(18)7-9-3-5-10(6-4-9)17(20)21/h3-6H,7H2,1-2H3,(H,15,16,18)