3-methyl-4-(pyrazin-2-ylmethylsulfanyl)aniline

Systemtic Name: 3-methyl-4-(pyrazin-2-ylmethylsulfanyl)aniline Openeye Name: 3-methyl-4-(pyrazin-2-ylmethylsulfanyl)aniline CAS Name: 3-methyl-4-(2-pyrazinylmethylthio)aniline IUPAC Name: 3-methyl-4-(pyrazin-2-ylmethylsulfanyl)aniline Traditional Name: [3-methyl-4-(pyrazin-2-ylmethylthio)phenyl]amine Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3S/c1-9-6-10(13)2-3-12(9)16-8-11-7-14-4-5-15-11/h2-7H,8,13H2,1H3