N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C20H26N4O3S2 MolecularWeight: 434.57544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)NCCS(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)NCCS(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H26N4O3S2/c25-20(18-15-16-5-1-2-6-17(16)28-18)22-9-14-29(26,27)24-12-10-23(11-13-24)19-7-3-4-8-21-19/h3-4,7-8,15H,1-2,5-6,9-14H2,(H,22,25)