(2S)-2-(3H-imidazo[4,5-c]pyridin-5-ium-2-yl)-3-phenyl-propane-1-thiol

Systemtic Name: (2S)-2-(3H-imidazo[4,5-c]pyridin-5-ium-2-yl)-3-phenyl-propane-1-thiol Openeye Name: (2S)-2-(3H-imidazo[4,5-c]pyridin-5-ium-2-yl)-3-phenyl-propane-1-thiol CAS Name: (2S)-2-(3H-imidazo[4,5-c]pyridin-5-ium-2-yl)-3-phenyl-1-propanethiol IUPAC Name: (2S)-2-(3H-imidazo[4,5-c]pyridin-5-ium-2-yl)-3-phenylpropane-1-thiol Traditional Name: (2S)-2-(3H-imidazo[4,5-c]pyridin-5-ium-2-yl)-3-phenyl-propane-1-thiol Formula: C15H16N3S+ MolecularWeight: 270.37264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)C2=NC3=C(N2)C=[NH+]C=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](CS)C2=NC3=C(N2)C=[NH+]C=C3

InChI

InChI=1S/C15H15N3S/c19-10-12(8-11-4-2-1-3-5-11)15-17-13-6-7-16-9-14(13)18-15/h1-7,9,12,19H,8,10H2,(H,17,18)/p+1/t12-/m1/s1