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

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2,3-dihydro-1-benzofuran-5-sulfonamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-2,3-dihydrobenzofuran-5-sulfonamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-2,3-dihydrobenzofuran-5-sulfonamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2,3-dihydro-1-benzofuran-5-sulfonamide Traditional Name: N-[3-[4-(m-tolyl)piperazino]propyl]coumaran-5-sulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C22H29N3O3S/c1-18-4-2-5-20(16-18)25-13-11-24(12-14-25)10-3-9-23-29(26,27)21-6-7-22-19(17-21)8-15-28-22/h2,4-7,16-17,23H,3,8-15H2,1H3