2-[3-[[5-(2,4-dimethoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propyl]-7-methylsulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[3-[[5-(2,4-dimethoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propyl]-7-methylsulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[3-[[5-(2,4-dimethoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propyl]-7-methylsulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[3-[[5-(2,4-dimethoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propyl]-7-methylsulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[3-[[5-(2,4-dimethoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propyl]-7-methylsulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[3-[[5-(2,4-dimethoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propyl]-7-mesyl-3,4-dihydro-1H-isoquinoline Formula: C24H30N4O4S2 MolecularWeight: 502.6494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCN2CCC3=C(C2)C=C(C=C3)S(=O)(=O)C)C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CN1C(=NN=C1SCCCN2CCC3=C(C2)C=C(C=C3)S(=O)(=O)C)C4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C24H30N4O4S2/c1-27-23(21-9-7-19(31-2)15-22(21)32-3)25-26-24(27)33-13-5-11-28-12-10-17-6-8-20(34(4,29)30)14-18(17)16-28/h6-9,14-15H,5,10-13,16H2,1-4H3