[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-thiophen-2-ylethanoate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-thiophen-2-ylethanoate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C21H21NO4S2 MolecularWeight: 415.52574

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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)CC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)CC3=CC=CS3)C

InChI

InChI=1S/C21H21NO4S2/c1-15-6-11-20(13-16(15)2)28(24,25)22(3)17-7-9-18(10-8-17)26-21(23)14-19-5-4-12-27-19/h4-13H,14H2,1-3H3