2-[[4-(imidazol-1-ylmethyl)phenyl]methylsulfanyl]ethanamine

Systemtic Name: 2-[[4-(imidazol-1-ylmethyl)phenyl]methylsulfanyl]ethanamine Openeye Name: 2-[[4-(imidazol-1-ylmethyl)phenyl]methylsulfanyl]ethanamine CAS Name: 2-[[4-(1-imidazolylmethyl)phenyl]methylthio]ethanamine IUPAC Name: 2-[[4-(imidazol-1-ylmethyl)phenyl]methylsulfanyl]ethanamine Traditional Name: 2-[[4-(imidazol-1-ylmethyl)benzyl]thio]ethylamine Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CN=C2)CSCCN

Isomeric SMILES

C1=CC(=CC=C1CN2C=CN=C2)CSCCN

InChI

InChI=1S/C13H17N3S/c14-5-8-17-10-13-3-1-12(2-4-13)9-16-7-6-15-11-16/h1-4,6-7,11H,5,8-10,14H2