3,5-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrazol-4-amine

Systemtic Name: 3,5-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrazol-4-amine Openeye Name: 3,5-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrazol-4-amine CAS Name: 3,5-dimethyl-N-[[4-(methylthio)phenyl]methyl]-1H-pyrazol-4-amine IUPAC Name: 3,5-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-1H-pyrazol-4-amine Traditional Name: (3,5-dimethyl-1H-pyrazol-4-yl)-[4-(methylthio)benzyl]amine Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NCC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=C(C(=NN1)C)NCC2=CC=C(C=C2)SC

InChI

InChI=1S/C13H17N3S/c1-9-13(10(2)16-15-9)14-8-11-4-6-12(17-3)7-5-11/h4-7,14H,8H2,1-3H3,(H,15,16)