4-isoquinolin-5-ylsulfonylbenzene-1,2-diamine trihydrochloride

Systemtic Name: 4-isoquinolin-5-ylsulfonylbenzene-1,2-diamine trihydrochloride Openeye Name: 4-(5-isoquinolylsulfonyl)benzene-1,2-diamine trihydrochloride CAS Name: 4-(5-isoquinolinylsulfonyl)benzene-1,2-diamine trihydrochloride IUPAC Name: 4-isoquinolin-5-ylsulfonylbenzene-1,2-diamine trihydrochloride Traditional Name: [2-amino-4-(5-isoquinolylsulfonyl)phenyl]amine trihydrochloride Formula: C15H16Cl3N3O2S MolecularWeight: 408.73044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)C3=CC(=C(C=C3)N)N.Cl.Cl.Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)C3=CC(=C(C=C3)N)N.Cl.Cl.Cl

InChI

InChI=1S/C15H13N3O2S.3ClH/c16-13-5-4-11(8-14(13)17)21(19,20)15-3-1-2-10-9-18-7-6-12(10)15;;;/h1-9H,16-17H2;3*1H