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

Systemtic Name: 1-chloranyl-N-[2-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]isoquinoline-5-sulfonamide Openeye Name: 1-chloro-N-[2-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]isoquinoline-5-sulfonamide CAS Name: 1-chloro-N-[2-[4-(3-phenoxypropyl)-1-piperazinyl]ethyl]-5-isoquinolinesulfonamide IUPAC Name: 1-chloro-N-[2-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]isoquinoline-5-sulfonamide Traditional Name: 1-chloro-N-[2-[4-(3-phenoxypropyl)piperazino]ethyl]isoquinoline-5-sulfonamide Formula: C24H29ClN4O3S MolecularWeight: 489.03006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=CC=C2)CCNS(=O)(=O)C3=CC=CC4=C3C=CN=C4Cl

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=CC=C2)CCNS(=O)(=O)C3=CC=CC4=C3C=CN=C4Cl

InChI

InChI=1S/C24H29ClN4O3S/c25-24-22-8-4-9-23(21(22)10-11-26-24)33(30,31)27-12-14-29-17-15-28(16-18-29)13-5-19-32-20-6-2-1-3-7-20/h1-4,6-11,27H,5,12-19H2