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

Systemtic Name: 5-tert-butyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C24H34N4O3S2 MolecularWeight: 490.68176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N4O3S2/c1-24(2,3)19-7-8-20-18(16-19)17-21(32-20)23(29)26-10-15-33(30,31)28-13-11-27(12-14-28)22-6-4-5-9-25-22/h4-6,9,17,19H,7-8,10-16H2,1-3H3,(H,26,29)