N-ethyl-N-(5-piperidin-1-ylpentyl)isoquinoline-5-sulfonamide

Systemtic Name: N-ethyl-N-(5-piperidin-1-ylpentyl)isoquinoline-5-sulfonamide Openeye Name: N-ethyl-N-[5-(1-piperidyl)pentyl]isoquinoline-5-sulfonamide CAS Name: N-ethyl-N-[5-(1-piperidinyl)pentyl]-5-isoquinolinesulfonamide IUPAC Name: N-ethyl-N-(5-piperidin-1-ylpentyl)isoquinoline-5-sulfonamide Traditional Name: N-ethyl-N-(5-piperidinopentyl)isoquinoline-5-sulfonamide Formula: C21H31N3O2S MolecularWeight: 389.55474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCCN1CCCCC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCN(CCCCCN1CCCCC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C21H31N3O2S/c1-2-24(17-8-4-7-16-23-14-5-3-6-15-23)27(25,26)21-11-9-10-19-18-22-13-12-20(19)21/h9-13,18H,2-8,14-17H2,1H3