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

Systemtic Name: 2-[1-[2-[[4-(imidazol-1-ylmethyl)phenyl]methylsulfanyl]ethyl]piperidin-4-yl]ethanamine Openeye Name: 2-[1-[2-[[4-(imidazol-1-ylmethyl)phenyl]methylsulfanyl]ethyl]-4-piperidyl]ethanamine CAS Name: 2-[1-[2-[[4-(1-imidazolylmethyl)phenyl]methylthio]ethyl]-4-piperidinyl]ethanamine IUPAC Name: 2-[1-[2-[[4-(imidazol-1-ylmethyl)phenyl]methylsulfanyl]ethyl]piperidin-4-yl]ethanamine Traditional Name: 2-[1-[2-[[4-(imidazol-1-ylmethyl)benzyl]thio]ethyl]-4-piperidyl]ethylamine Formula: C20H30N4S MolecularWeight: 358.544

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCN)CCSCC2=CC=C(C=C2)CN3C=CN=C3

Isomeric SMILES

C1CN(CCC1CCN)CCSCC2=CC=C(C=C2)CN3C=CN=C3

InChI

InChI=1S/C20H30N4S/c21-8-5-18-6-10-23(11-7-18)13-14-25-16-20-3-1-19(2-4-20)15-24-12-9-22-17-24/h1-4,9,12,17-18H,5-8,10-11,13-16,21H2