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

Systemtic Name: ethyl 4-methyl-2-[2-(4-nitrophenyl)sulfanylethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[(4-nitrophenyl)thio]acetyl]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)CSC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H15N3O5S2/c1-3-23-14(20)13-9(2)16-15(25-13)17-12(19)8-24-11-6-4-10(5-7-11)18(21)22/h4-7H,3,8H2,1-2H3,(H,16,17,19)