6,7-dimethoxy-2-[(4-pyrazol-1-ylphenyl)methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[(4-pyrazol-1-ylphenyl)methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[(4-pyrazol-1-ylphenyl)methyl]-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[[4-(1-pyrazolyl)phenyl]methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[(4-pyrazol-1-ylphenyl)methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-(4-pyrazol-1-ylbenzyl)-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC3=CC=C(C=C3)N4C=CC=N4)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC3=CC=C(C=C3)N4C=CC=N4)C5=CC=CS5)OC

InChI

InChI=1S/C25H25N3O2S/c1-29-22-15-19-10-13-27(17-18-6-8-20(9-7-18)28-12-4-11-26-28)25(24-5-3-14-31-24)21(19)16-23(22)30-2/h3-9,11-12,14-16,25H,10,13,17H2,1-2H3