N-hexyl-1-isoquinolin-5-ylsulfonyl-piperidin-3-amine

Systemtic Name: N-hexyl-1-isoquinolin-5-ylsulfonyl-piperidin-3-amine Openeye Name: N-hexyl-1-(5-isoquinolylsulfonyl)piperidin-3-amine CAS Name: N-hexyl-1-(5-isoquinolinylsulfonyl)-3-piperidinamine IUPAC Name: N-hexyl-1-isoquinolin-5-ylsulfonylpiperidin-3-amine Traditional Name: hexyl-[1-(5-isoquinolylsulfonyl)-3-piperidyl]amine Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1CCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCCCCNC1CCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C20H29N3O2S/c1-2-3-4-5-12-22-18-9-7-14-23(16-18)26(24,25)20-10-6-8-17-15-21-13-11-19(17)20/h6,8,10-11,13,15,18,22H,2-5,7,9,12,14,16H2,1H3