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

Systemtic Name: ethyl 2-methylsulfanyl-4-[(4-nitrophenyl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-[(4-nitrobenzoyl)amino]thiazole-5-carboxylate CAS Name: 2-(methylthio)-4-[[(4-nitrophenyl)-oxomethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-[(4-nitrobenzoyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-(methylthio)-4-[(4-nitrobenzoyl)amino]thiazole-5-carboxylic acid ethyl ester Formula: C14H13N3O5S2 MolecularWeight: 367.40012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O5S2/c1-3-22-13(19)10-11(16-14(23-2)24-10)15-12(18)8-4-6-9(7-5-8)17(20)21/h4-7H,3H2,1-2H3,(H,15,18)