6-methylsulfanyl-2-[3-(1,2,3,4-tetrazol-1-yl)propyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6-methylsulfanyl-2-[3-(1,2,3,4-tetrazol-1-yl)propyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6-methylsulfanyl-2-[3-(tetrazol-1-yl)propyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6-(methylthio)-2-[3-(1-tetrazolyl)propyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6-methylsulfanyl-2-[3-(tetrazol-1-yl)propyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6-(methylthio)-2-[3-(tetrazol-1-yl)propyl]-3,4-dihydro-1H-isoquinoline Formula: C14H19N5S MolecularWeight: 289.39916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(CN(CC2)CCCN3C=NN=N3)C=C1

Isomeric SMILES

CSC1=CC2=C(CN(CC2)CCCN3C=NN=N3)C=C1

InChI

InChI=1S/C14H19N5S/c1-20-14-4-3-13-10-18(8-5-12(13)9-14)6-2-7-19-11-15-16-17-19/h3-4,9,11H,2,5-8,10H2,1H3