methyl 5-phenyl-3-[(4-propan-2-ylsulfonylphenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-phenyl-3-[(4-propan-2-ylsulfonylphenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(4-isopropylsulfonylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[oxo-(4-propan-2-ylsulfonylphenyl)methyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-phenyl-3-[(4-propan-2-ylsulfonylbenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(4-isopropylsulfonylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C22H21NO5S2 MolecularWeight: 443.53584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H21NO5S2/c1-14(2)30(26,27)17-11-9-16(10-12-17)21(24)23-18-13-19(15-7-5-4-6-8-15)29-20(18)22(25)28-3/h4-14H,1-3H3,(H,23,24)