5-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]aniline

Systemtic Name: 5-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]aniline Openeye Name: 5-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]aniline CAS Name: 5-methyl-2-[(1-methyl-4-pyrazolyl)methylthio]aniline IUPAC Name: 5-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]aniline Traditional Name: [5-methyl-2-[(1-methylpyrazol-4-yl)methylthio]phenyl]amine Formula: C12H15N3S MolecularWeight: 233.3326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=CN(N=C2)C)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=CN(N=C2)C)N

InChI

InChI=1S/C12H15N3S/c1-9-3-4-12(11(13)5-9)16-8-10-6-14-15(2)7-10/h3-7H,8,13H2,1-2H3