[azanyl-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)methylsulfanyl]methylidene]azanium chloride

Systemtic Name: [azanyl-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)methylsulfanyl]methylidene]azanium chloride Openeye Name: [amino-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)methylsulfanyl]methylene]ammonium chloride CAS Name: [amino-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)methylthio]methylidene]ammonium chloride IUPAC Name: [amino-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)methylsulfanyl]methylidene]azanium chloride Traditional Name: [amino-[(3-ethyl-3-methyl-4H-isoquinolin-1-yl)methylthio]methylene]ammonium chloride Formula: C14H20ClN3S MolecularWeight: 297.8467

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C(=N1)CSC(=[NH2+])N)C.[Cl-]

Isomeric SMILES

CCC1(CC2=CC=CC=C2C(=N1)CSC(=[NH2+])N)C.[Cl-]

InChI

InChI=1S/C14H19N3S.ClH/c1-3-14(2)8-10-6-4-5-7-11(10)12(17-14)9-18-13(15)16;/h4-7H,3,8-9H2,1-2H3,(H3,15,16);1H