[2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 4-methylsulfonylbenzoate

Systemtic Name: [2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 4-methylsulfonylbenzoate Openeye Name: [2-(N-acetylanilino)thiazol-4-yl]methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [2-(N-acetylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetylanilino)-1,3-thiazol-4-yl]methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [2-(N-acetylanilino)thiazol-4-yl]methyl ester Formula: C20H18N2O5S2 MolecularWeight: 430.49732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H18N2O5S2/c1-14(23)22(17-6-4-3-5-7-17)20-21-16(13-28-20)12-27-19(24)15-8-10-18(11-9-15)29(2,25)26/h3-11,13H,12H2,1-2H3