2-[(4-imidazol-1-ylphenyl)methylsulfanyl]-5-methyl-aniline

Systemtic Name: 2-[(4-imidazol-1-ylphenyl)methylsulfanyl]-5-methyl-aniline Openeye Name: 2-[(4-imidazol-1-ylphenyl)methylsulfanyl]-5-methyl-aniline CAS Name: 2-[[4-(1-imidazolyl)phenyl]methylthio]-5-methylaniline IUPAC Name: 2-[(4-imidazol-1-ylphenyl)methylsulfanyl]-5-methylaniline Traditional Name: [2-[(4-imidazol-1-ylbenzyl)thio]-5-methyl-phenyl]amine Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=CC=C(C=C2)N3C=CN=C3)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=CC=C(C=C2)N3C=CN=C3)N

InChI

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