N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-2,3-dihydro-1-benzofuran-5-carboxamide

Systemtic Name: N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-2,3-dihydro-1-benzofuran-5-carboxamide Openeye Name: N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]-2,3-dihydrobenzofuran-5-carboxamide CAS Name: N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]-2,3-dihydrobenzofuran-5-carboxamide IUPAC Name: N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]-2,3-dihydro-1-benzofuran-5-carboxamide Traditional Name: N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]coumaran-5-carboxamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C(=O)NCCS(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1COC2=C1C=C(C=C2)C(=O)NCCS(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H24N4O4S/c25-20(17-4-5-18-16(15-17)6-13-28-18)22-8-14-29(26,27)24-11-9-23(10-12-24)19-3-1-2-7-21-19/h1-5,7,15H,6,8-14H2,(H,22,25)