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

Systemtic Name: ethyl 4-methyl-2-[(4-methylsulfanyl-3-nitro-phenyl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[(4-methylsulfanyl-3-nitro-benzoyl)amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[[4-(methylthio)-3-nitrophenyl]-oxomethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(4-methylsulfanyl-3-nitrobenzoyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[4-(methylthio)-3-nitro-benzoyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C15H15N3O5S2 MolecularWeight: 381.4267

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-])C

InChI

InChI=1S/C15H15N3O5S2/c1-4-23-14(20)12-8(2)16-15(25-12)17-13(19)9-5-6-11(24-3)10(7-9)18(21)22/h5-7H,4H2,1-3H3,(H,16,17,19)