ethyl 3-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-4-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-4-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-4-phenyl-thiophene-2-carboxylate CAS Name: 3-[[4-(3-methoxyphenyl)-1-piperazinyl]sulfonyl]-4-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-4-phenylthiophene-2-carboxylate Traditional Name: 3-[4-(3-methoxyphenyl)piperazino]sulfonyl-4-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C24H26N2O5S2 MolecularWeight: 486.60364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CS1)C2=CC=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=CS1)C2=CC=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C24H26N2O5S2/c1-3-31-24(27)22-23(21(17-32-22)18-8-5-4-6-9-18)33(28,29)26-14-12-25(13-15-26)19-10-7-11-20(16-19)30-2/h4-11,16-17H,3,12-15H2,1-2H3