5-[5-methyl-2-(phenylmethylsulfanyl)phenyl]-1H-pyrazol-3-amine

Systemtic Name: 5-[5-methyl-2-(phenylmethylsulfanyl)phenyl]-1H-pyrazol-3-amine Openeye Name: 5-(2-benzylsulfanyl-5-methyl-phenyl)-1H-pyrazol-3-amine CAS Name: 5-[5-methyl-2-(phenylmethylthio)phenyl]-1H-pyrazol-3-amine IUPAC Name: 5-(2-benzylsulfanyl-5-methylphenyl)-1H-pyrazol-3-amine Traditional Name: [5-[2-(benzylthio)-5-methyl-phenyl]-1H-pyrazol-3-yl]amine Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=CC=CC=C2)C3=CC(=NN3)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=CC=CC=C2)C3=CC(=NN3)N

InChI

InChI=1S/C17H17N3S/c1-12-7-8-16(21-11-13-5-3-2-4-6-13)14(9-12)15-10-17(18)20-19-15/h2-10H,11H2,1H3,(H3,18,19,20)