4-[[3-[(6-chloranylnaphthalen-2-yl)sulfonyl-ethyl-amino]-2-oxidanyl-propyl]amino]benzenecarboximidamide

Systemtic Name: 4-[[3-[(6-chloranylnaphthalen-2-yl)sulfonyl-ethyl-amino]-2-oxidanyl-propyl]amino]benzenecarboximidamide Openeye Name: 4-[[3-[(6-chloro-2-naphthyl)sulfonyl-ethyl-amino]-2-hydroxy-propyl]amino]benzamidine CAS Name: 4-[[3-[(6-chloro-2-naphthalenyl)sulfonyl-ethylamino]-2-hydroxypropyl]amino]benzenecarboximidamide IUPAC Name: 4-[[3-[(6-chloronaphthalen-2-yl)sulfonyl-ethylamino]-2-hydroxypropyl]amino]benzenecarboximidamide Traditional Name: 4-[[3-[(6-chloro-2-naphthyl)sulfonyl-ethyl-amino]-2-hydroxy-propyl]amino]benzamidine Formula: C22H25ClN4O3S MolecularWeight: 460.9769

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(CNC1=CC=C(C=C1)C(=N)N)O)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

Isomeric SMILES

CCN(CC(CNC1=CC=C(C=C1)C(=N)N)O)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN4O3S/c1-2-27(14-20(28)13-26-19-8-4-15(5-9-19)22(24)25)31(29,30)21-10-6-16-11-18(23)7-3-17(16)12-21/h3-12,20,26,28H,2,13-14H2,1H3,(H3,24,25)