2-[2-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1,3-thiazol-4-yl]ethylazanium

Systemtic Name: 2-[2-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1,3-thiazol-4-yl]ethylazanium Openeye Name: 2-[2-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]thiazol-4-yl]ethylammonium CAS Name: 2-[2-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-thiazolyl]ethylammonium IUPAC Name: 2-[2-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1,3-thiazol-4-yl]ethylazanium Traditional Name: 2-[2-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]thiazol-4-yl]ethylammonium Formula: C16H22N3S+ MolecularWeight: 288.43098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=CS1)CC[NH3+])N2CCC3=CC=CC=C3C2

Isomeric SMILES

C[C@@H](C1=NC(=CS1)CC[NH3+])N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H21N3S/c1-12(16-18-15(6-8-17)11-20-16)19-9-7-13-4-2-3-5-14(13)10-19/h2-5,11-12H,6-10,17H2,1H3/p+1/t12-/m0/s1