ethyl 2-[(3-methylsulfonylphenyl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(3-methylsulfonylphenyl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3-methylsulfonylbenzoyl)amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-methylsulfonylbenzoyl)amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3-mesylbenzoyl)amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H18N2O5S2 MolecularWeight: 430.49732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O5S2/c1-3-27-19(24)17-16(13-8-5-4-6-9-13)21-20(28-17)22-18(23)14-10-7-11-15(12-14)29(2,25)26/h4-12H,3H2,1-2H3,(H,21,22,23)