[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] thiocyanate hydrochloride

Systemtic Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] thiocyanate hydrochloride Openeye Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] thiocyanate hydrochloride CAS Name: thiocyanic acid [4-[(4,6-dimethyl-2-pyrimidinyl)amino]phenyl] ester hydrochloride IUPAC Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] thiocyanate hydrochloride Traditional Name: thiocyanic acid [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] ester hydrochloride Formula: C13H13ClN4S MolecularWeight: 292.78712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)SC#N)C.Cl

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)SC#N)C.Cl

InChI

InChI=1S/C13H12N4S.ClH/c1-9-7-10(2)16-13(15-9)17-11-3-5-12(6-4-11)18-8-14;/h3-7H,1-2H3,(H,15,16,17);1H