azanylidyneazanium; 2,5-dimethoxy-4-(2-methylphenyl)benzenethiol; chloride

Systemtic Name: azanylidyneazanium; 2,5-dimethoxy-4-(2-methylphenyl)benzenethiol; chloride Openeye Name: 2,5-dimethoxy-4-(o-tolyl)benzenethiol; nitridoammonium; chloride CAS Name: 2,5-dimethoxy-4-(2-methylphenyl)benzenethiol; nitriloammonium; chloride IUPAC Name: azanylidyneazanium; 2,5-dimethoxy-4-(2-methylphenyl)benzenethiol; chloride Traditional Name: 2,5-dimethoxy-4-(o-tolyl)benzenethiol; nitriloammonium; chloride Formula: C15H17ClN2O2S MolecularWeight: 324.82568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=C(C=C2OC)S)OC.[NH+]#N.[Cl-]

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=C(C=C2OC)S)OC.[NH+]#N.[Cl-]

InChI

InChI=1S/C15H16O2S.ClH.N2/c1-10-6-4-5-7-11(10)12-8-14(17-3)15(18)9-13(12)16-2;;1-2/h4-9,18H,1-3H3;1H;