ethyl 3-(4-phenylpiperazin-1-yl)sulfonyl-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-(4-phenylpiperazin-1-yl)sulfonyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-(4-phenylpiperazin-1-yl)sulfonylbenzothiophene-2-carboxylate CAS Name: 3-[(4-phenyl-1-piperazinyl)sulfonyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-phenylpiperazin-1-yl)sulfonyl-1-benzothiophene-2-carboxylate Traditional Name: 3-(4-phenylpiperazino)sulfonylbenzothiophene-2-carboxylic acid ethyl ester Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O4S2/c1-2-27-21(24)19-20(17-10-6-7-11-18(17)28-19)29(25,26)23-14-12-22(13-15-23)16-8-4-3-5-9-16/h3-11H,2,12-15H2,1H3