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

Systemtic Name: azanylidyneazanium; 2,5-diethoxy-4-(4-methylphenyl)benzenethiol; chloride Openeye Name: 2,5-diethoxy-4-(p-tolyl)benzenethiol; nitridoammonium; chloride CAS Name: 2,5-diethoxy-4-(4-methylphenyl)benzenethiol; nitriloammonium; chloride IUPAC Name: azanylidyneazanium; 2,5-diethoxy-4-(4-methylphenyl)benzenethiol; chloride Traditional Name: 2,5-diethoxy-4-(p-tolyl)benzenethiol; nitriloammonium; chloride Formula: C17H21ClN2O2S MolecularWeight: 352.87884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C2=CC=C(C=C2)C)OCC)S.[NH+]#N.[Cl-]

Isomeric SMILES

CCOC1=CC(=C(C=C1C2=CC=C(C=C2)C)OCC)S.[NH+]#N.[Cl-]

InChI

InChI=1S/C17H20O2S.ClH.N2/c1-4-18-15-11-17(20)16(19-5-2)10-14(15)13-8-6-12(3)7-9-13;;1-2/h6-11,20H,4-5H2,1-3H3;1H;