N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-5-sulfonamide

Systemtic Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-5-sulfonamide Openeye Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2,3-dihydrobenzofuran-5-sulfonamide CAS Name: N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-2,3-dihydrobenzofuran-5-sulfonamide IUPAC Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-5-sulfonamide Traditional Name: N-[3-[4-(2-pyrimidyl)piperazino]propyl]coumaran-5-sulfonamide Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)S(=O)(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1COC2=C1C=C(C=C2)S(=O)(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H25N5O3S/c25-28(26,17-3-4-18-16(15-17)5-14-27-18)22-8-2-9-23-10-12-24(13-11-23)19-20-6-1-7-21-19/h1,3-4,6-7,15,22H,2,5,8-14H2