1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanone

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanone Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(3-thienyl)tetrazol-2-yl]ethanone CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(3-thiophenyl)-2-tetrazolyl]ethanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-thiophen-3-yltetrazol-2-yl)ethanone Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(3-thienyl)tetrazol-2-yl]ethanone Formula: C18H19N5O3S MolecularWeight: 385.44016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CN3N=C(N=N3)C4=CSC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CN3N=C(N=N3)C4=CSC=C4)OC

InChI

InChI=1S/C18H19N5O3S/c1-25-15-7-12-3-5-22(9-14(12)8-16(15)26-2)17(24)10-23-20-18(19-21-23)13-4-6-27-11-13/h4,6-8,11H,3,5,9-10H2,1-2H3