[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] thiophene-2-carboxylate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] thiophene-2-carboxylate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C20H19NO4S2 MolecularWeight: 401.49916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CC=CS3)C

InChI

InChI=1S/C20H19NO4S2/c1-14-6-11-18(13-15(14)2)27(23,24)21(3)16-7-9-17(10-8-16)25-20(22)19-5-4-12-26-19/h4-13H,1-3H3