ethyl 6-methyl-2-[(3-methylsulfonylphenyl)carbonylamino]thieno[2,3-d][1,3]thiazole-5-carboxylate

Systemtic Name: ethyl 6-methyl-2-[(3-methylsulfonylphenyl)carbonylamino]thieno[2,3-d][1,3]thiazole-5-carboxylate Openeye Name: ethyl 6-methyl-2-[(3-methylsulfonylbenzoyl)amino]thieno[2,3-d]thiazole-5-carboxylate CAS Name: 6-methyl-2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-5-thieno[2,3-d]thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[(3-methylsulfonylbenzoyl)amino]thieno[2,3-d][1,3]thiazole-5-carboxylate Traditional Name: 2-[(3-mesylbenzoyl)amino]-6-methyl-thieno[2,3-d]thiazole-5-carboxylic acid ethyl ester Formula: C17H16N2O5S3 MolecularWeight: 424.51434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)C

InChI

InChI=1S/C17H16N2O5S3/c1-4-24-16(21)13-9(2)12-15(25-13)19-17(26-12)18-14(20)10-6-5-7-11(8-10)27(3,22)23/h5-8H,4H2,1-3H3,(H,18,19,20)