N-[2-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]isoquinoline-5-sulfonamide CAS Name: N-[2-[4-(3-phenoxypropyl)-1-piperazinyl]ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-[4-(3-phenoxypropyl)piperazino]ethyl]isoquinoline-5-sulfonamide Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=CC=C2)CCNS(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=CC=C2)CCNS(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C24H30N4O3S/c29-32(30,24-9-4-6-21-20-25-11-10-23(21)24)26-12-14-28-17-15-27(16-18-28)13-5-19-31-22-7-2-1-3-8-22/h1-4,6-11,20,26H,5,12-19H2