N-[(4-imidazol-1-ylphenyl)methyl]-2-methylsulfanyl-aniline

Systemtic Name: N-[(4-imidazol-1-ylphenyl)methyl]-2-methylsulfanyl-aniline Openeye Name: N-[(4-imidazol-1-ylphenyl)methyl]-2-methylsulfanyl-aniline CAS Name: N-[[4-(1-imidazolyl)phenyl]methyl]-2-(methylthio)aniline IUPAC Name: N-[(4-imidazol-1-ylphenyl)methyl]-2-methylsulfanylaniline Traditional Name: (4-imidazol-1-ylbenzyl)-[2-(methylthio)phenyl]amine Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NCC2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CSC1=CC=CC=C1NCC2=CC=C(C=C2)N3C=CN=C3

InChI

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