2-[4-[2-[(4-imidazol-1-ylphenyl)methylsulfanyl]ethyl]piperazin-1-yl]ethanamine

Systemtic Name: 2-[4-[2-[(4-imidazol-1-ylphenyl)methylsulfanyl]ethyl]piperazin-1-yl]ethanamine Openeye Name: 2-[4-[2-[(4-imidazol-1-ylphenyl)methylsulfanyl]ethyl]piperazin-1-yl]ethanamine CAS Name: 2-[4-[2-[[4-(1-imidazolyl)phenyl]methylthio]ethyl]-1-piperazinyl]ethanamine IUPAC Name: 2-[4-[2-[(4-imidazol-1-ylphenyl)methylsulfanyl]ethyl]piperazin-1-yl]ethanamine Traditional Name: 2-[4-[2-[(4-imidazol-1-ylbenzyl)thio]ethyl]piperazino]ethylamine Formula: C18H27N5S MolecularWeight: 345.50548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN)CCSCC2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

C1CN(CCN1CCN)CCSCC2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C18H27N5S/c19-5-7-21-9-11-22(12-10-21)13-14-24-15-17-1-3-18(4-2-17)23-8-6-20-16-23/h1-4,6,8,16H,5,7,9-15,19H2