N1-(3-imidazol-1-ylpropyl)-4-methylsulfonyl-benzene-1,2-diamine

Systemtic Name: N1-(3-imidazol-1-ylpropyl)-4-methylsulfonyl-benzene-1,2-diamine Openeye Name: N1-(3-imidazol-1-ylpropyl)-4-methylsulfonyl-benzene-1,2-diamine CAS Name: N1-[3-(1-imidazolyl)propyl]-4-methylsulfonylbenzene-1,2-diamine IUPAC Name: 1-N-(3-imidazol-1-ylpropyl)-4-methylsulfonylbenzene-1,2-diamine Traditional Name: (2-amino-4-mesyl-phenyl)-(3-imidazol-1-ylpropyl)amine Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCCN2C=CN=C2)N

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCCN2C=CN=C2)N

InChI

InChI=1S/C13H18N4O2S/c1-20(18,19)11-3-4-13(12(14)9-11)16-5-2-7-17-8-6-15-10-17/h3-4,6,8-10,16H,2,5,7,14H2,1H3