2-isoquinolin-5-ylsulfonyl-1-(3-phenylpropyl)piperidin-2-amine

Systemtic Name: 2-isoquinolin-5-ylsulfonyl-1-(3-phenylpropyl)piperidin-2-amine Openeye Name: 2-(5-isoquinolylsulfonyl)-1-(3-phenylpropyl)piperidin-2-amine CAS Name: 2-(5-isoquinolinylsulfonyl)-1-(3-phenylpropyl)-2-piperidinamine IUPAC Name: 2-isoquinolin-5-ylsulfonyl-1-(3-phenylpropyl)piperidin-2-amine Traditional Name: [2-(5-isoquinolylsulfonyl)-1-(3-phenylpropyl)-2-piperidyl]amine Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)(N)S(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)(N)S(=O)(=O)C2=CC=CC3=C2C=CN=C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S/c24-23(29(27,28)22-12-6-11-20-18-25-15-13-21(20)22)14-4-5-16-26(23)17-7-10-19-8-2-1-3-9-19/h1-3,6,8-9,11-13,15,18H,4-5,7,10,14,16-17,24H2