2,3-bis(azanyl)-2-(4-methylisoquinolin-5-yl)sulfonyl-hexan-3-ol

Systemtic Name: 2,3-bis(azanyl)-2-(4-methylisoquinolin-5-yl)sulfonyl-hexan-3-ol Openeye Name: 2,3-diamino-2-[(4-methyl-5-isoquinolyl)sulfonyl]hexan-3-ol CAS Name: 2,3-diamino-2-[(4-methyl-5-isoquinolinyl)sulfonyl]-3-hexanol IUPAC Name: 2,3-diamino-2-(4-methylisoquinolin-5-yl)sulfonylhexan-3-ol Traditional Name: 2,3-diamino-2-[(4-methyl-5-isoquinolyl)sulfonyl]hexan-3-ol Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)(N)S(=O)(=O)C1=CC=CC2=CN=CC(=C21)C)(N)O

Isomeric SMILES

CCCC(C(C)(N)S(=O)(=O)C1=CC=CC2=CN=CC(=C21)C)(N)O

InChI

InChI=1S/C16H23N3O3S/c1-4-8-16(18,20)15(3,17)23(21,22)13-7-5-6-12-10-19-9-11(2)14(12)13/h5-7,9-10,20H,4,8,17-18H2,1-3H3