3-(1H-benzimidazol-2-ylsulfinylmethyl)-N,N-dimethyl-pyridin-2-amine hydrate

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfinylmethyl)-N,N-dimethyl-pyridin-2-amine hydrate Openeye Name: 3-(1H-benzimidazol-2-ylsulfinylmethyl)-N,N-dimethyl-pyridin-2-amine hydrate CAS Name: 3-(1H-benzimidazol-2-ylsulfinylmethyl)-N,N-dimethyl-2-pyridinamine hydrate IUPAC Name: 3-(1H-benzimidazol-2-ylsulfinylmethyl)-N,N-dimethylpyridin-2-amine hydrate Traditional Name: [3-(1H-benzimidazol-2-ylsulfinylmethyl)-2-pyridyl]-dimethyl-amine hydrate Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=N1)CS(=O)C2=NC3=CC=CC=C3N2.O

Isomeric SMILES

CN(C)C1=C(C=CC=N1)CS(=O)C2=NC3=CC=CC=C3N2.O

InChI

InChI=1S/C15H16N4OS.H2O/c1-19(2)14-11(6-5-9-16-14)10-21(20)15-17-12-7-3-4-8-13(12)18-15;/h3-9H,10H2,1-2H3,(H,17,18);1H2