(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C16H12N2O4S3 MolecularWeight: 392.47248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SCC(=O)OCC2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SCC(=O)OCC2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C16H12N2O4S3/c19-15(10-24-14-3-1-13(2-4-14)18(20)21)22-7-12-9-25-16(17-12)11-5-6-23-8-11/h1-6,8-9H,7,10H2