[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C19H16N2O4S2 MolecularWeight: 400.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O4S2/c1-13-2-4-14(5-3-13)19-20-15(11-27-19)10-25-18(22)12-26-17-8-6-16(7-9-17)21(23)24/h2-9,11H,10,12H2,1H3