3-ethylsulfanyl-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline

Systemtic Name: 3-ethylsulfanyl-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline Openeye Name: 3-ethylsulfanyl-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline CAS Name: 3-(ethylthio)-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline IUPAC Name: 3-ethylsulfanyl-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline Traditional Name: 3-(ethylthio)-5,5-dimethyl-6H-[1,2,4]triazol[3,4-a]isoquinoline Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C2N1C(CC3=CC=CC=C32)(C)C

Isomeric SMILES

CCSC1=NN=C2N1C(CC3=CC=CC=C32)(C)C

InChI

InChI=1S/C14H17N3S/c1-4-18-13-16-15-12-11-8-6-5-7-10(11)9-14(2,3)17(12)13/h5-8H,4,9H2,1-3H3