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

Systemtic Name: 5-chloranyl-2-[(4-imidazol-1-ylphenyl)methylsulfanyl]aniline Openeye Name: 5-chloro-2-[(4-imidazol-1-ylphenyl)methylsulfanyl]aniline CAS Name: 5-chloro-2-[[4-(1-imidazolyl)phenyl]methylthio]aniline IUPAC Name: 5-chloro-2-[(4-imidazol-1-ylphenyl)methylsulfanyl]aniline Traditional Name: [5-chloro-2-[(4-imidazol-1-ylbenzyl)thio]phenyl]amine Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=C(C=C(C=C2)Cl)N)N3C=CN=C3

Isomeric SMILES

C1=CC(=CC=C1CSC2=C(C=C(C=C2)Cl)N)N3C=CN=C3

InChI

InChI=1S/C16H14ClN3S/c17-13-3-6-16(15(18)9-13)21-10-12-1-4-14(5-2-12)20-8-7-19-11-20/h1-9,11H,10,18H2