1H-indol-4-ylmethyl-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]azanium

Systemtic Name: 1H-indol-4-ylmethyl-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]azanium Openeye Name: 1H-indol-4-ylmethyl-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]ammonium CAS Name: 1H-indol-4-ylmethyl-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]ammonium IUPAC Name: 1H-indol-4-ylmethyl-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]azanium Traditional Name: 1H-indol-4-ylmethyl-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]ammonium Formula: C16H21N4S+ MolecularWeight: 301.42974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCC[NH2+]CC2=C3C=CNC3=CC=C2

Isomeric SMILES

CC1=C(N=CN1)CSCC[NH2+]CC2=C3C=CNC3=CC=C2

InChI

InChI=1S/C16H20N4S/c1-12-16(20-11-19-12)10-21-8-7-17-9-13-3-2-4-15-14(13)5-6-18-15/h2-6,11,17-18H,7-10H2,1H3,(H,19,20)/p+1