2-[[5-(phenylmethyl)-1H-imidazol-4-yl]methylsulfanyl]ethanamine

Systemtic Name: 2-[[5-(phenylmethyl)-1H-imidazol-4-yl]methylsulfanyl]ethanamine Openeye Name: 2-[(5-benzyl-1H-imidazol-4-yl)methylsulfanyl]ethanamine CAS Name: 2-[[5-(phenylmethyl)-1H-imidazol-4-yl]methylthio]ethanamine IUPAC Name: 2-[(5-benzyl-1H-imidazol-4-yl)methylsulfanyl]ethanamine Traditional Name: 2-[(5-benzyl-1H-imidazol-4-yl)methylthio]ethylamine Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N=CN2)CSCCN

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N=CN2)CSCCN

InChI

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