ethyl 2-[4-[(2,5-dimethylphenyl)sulfonyl-(thiophen-2-ylmethyl)amino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[(2,5-dimethylphenyl)sulfonyl-(thiophen-2-ylmethyl)amino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[(2,5-dimethylphenyl)sulfonyl-(2-thienylmethyl)amino]phenyl]acetate CAS Name: 2-[4-[(2,5-dimethylphenyl)sulfonyl-(thiophen-2-ylmethyl)amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(2,5-dimethylphenyl)sulfonyl-(thiophen-2-ylmethyl)amino]phenyl]acetate Traditional Name: 2-[4-[(2,5-dimethylphenyl)sulfonyl-(2-thenyl)amino]phenyl]acetic acid ethyl ester Formula: C23H25NO4S2 MolecularWeight: 443.5789

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)N(CC2=CC=CS2)S(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)N(CC2=CC=CS2)S(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H25NO4S2/c1-4-28-23(25)15-19-9-11-20(12-10-19)24(16-21-6-5-13-29-21)30(26,27)22-14-17(2)7-8-18(22)3/h5-14H,4,15-16H2,1-3H3