1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-(2-thienyl)tetrazol-5-one Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CN3C(=O)N(N=N3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CN3C(=O)N(N=N3)C4=CC=CS4)OC

InChI

InChI=1S/C17H19N5O3S/c1-24-14-8-12-5-6-20(10-13(12)9-15(14)25-2)11-21-17(23)22(19-18-21)16-4-3-7-26-16/h3-4,7-9H,5-6,10-11H2,1-2H3