1-ethylsulfanyl-2-methyl-isoquinolin-2-ium

Systemtic Name: 1-ethylsulfanyl-2-methyl-isoquinolin-2-ium Openeye Name: 1-ethylsulfanyl-2-methyl-isoquinolin-2-ium CAS Name: 1-(ethylthio)-2-methylisoquinolin-2-ium IUPAC Name: 1-ethylsulfanyl-2-methylisoquinolin-2-ium Traditional Name: 1-(ethylthio)-2-methyl-isoquinolin-2-ium Formula: C12H14NS+ MolecularWeight: 204.31126

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=[N+](C=CC2=CC=CC=C21)C

Isomeric SMILES

CCSC1=[N+](C=CC2=CC=CC=C21)C

InChI

InChI=1S/C12H14NS/c1-3-14-12-11-7-5-4-6-10(11)8-9-13(12)2/h4-9H,3H2,1-2H3/q+1