2-butyl-4-isoquinolin-5-ylsulfonyl-piperazine-1-carboximidamide

Systemtic Name: 2-butyl-4-isoquinolin-5-ylsulfonyl-piperazine-1-carboximidamide Openeye Name: 2-butyl-4-(5-isoquinolylsulfonyl)piperazine-1-carboxamidine CAS Name: 2-butyl-4-(5-isoquinolinylsulfonyl)-1-piperazinecarboximidamide IUPAC Name: 2-butyl-4-isoquinolin-5-ylsulfonylpiperazine-1-carboximidamide Traditional Name: 2-butyl-4-(5-isoquinolylsulfonyl)piperazine-1-carboxamidine Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1C(=N)N)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCCC1CN(CCN1C(=N)N)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C18H25N5O2S/c1-2-3-6-15-13-22(10-11-23(15)18(19)20)26(24,25)17-7-4-5-14-12-21-9-8-16(14)17/h4-5,7-9,12,15H,2-3,6,10-11,13H2,1H3,(H3,19,20)