N-[(5-chloranyl-1-methyl-imidazol-2-yl)methyl]-4-methylsulfanyl-aniline

Systemtic Name: N-[(5-chloranyl-1-methyl-imidazol-2-yl)methyl]-4-methylsulfanyl-aniline Openeye Name: N-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-4-methylsulfanyl-aniline CAS Name: N-[(5-chloro-1-methyl-2-imidazolyl)methyl]-4-(methylthio)aniline IUPAC Name: N-[(5-chloro-1-methylimidazol-2-yl)methyl]-4-methylsulfanylaniline Traditional Name: (5-chloro-1-methyl-imidazol-2-yl)methyl-[4-(methylthio)phenyl]amine Formula: C12H14ClN3S MolecularWeight: 267.77766

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1CNC2=CC=C(C=C2)SC)Cl

Isomeric SMILES

CN1C(=CN=C1CNC2=CC=C(C=C2)SC)Cl

InChI

InChI=1S/C12H14ClN3S/c1-16-11(13)7-15-12(16)8-14-9-3-5-10(17-2)6-4-9/h3-7,14H,8H2,1-2H3