2-[thiophen-2-ylmethyl-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]amino]ethanol

Systemtic Name: 2-[thiophen-2-ylmethyl-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]amino]ethanol Openeye Name: 2-[2-thienylmethyl-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]amino]ethanol CAS Name: 2-[thiophen-2-ylmethyl-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]amino]ethanol IUPAC Name: 2-[thiophen-2-ylmethyl-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]amino]ethanol Traditional Name: 2-[2-thenyl-[[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-4-yl]methyl]amino]ethanol Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C=NN2)CN(CCO)CC3=CC=CS3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C=NN2)CN(CCO)CC3=CC=CS3

InChI

InChI=1S/C20H25N3O4S/c1-25-17-9-14(10-18(26-2)20(17)27-3)19-15(11-21-22-19)12-23(6-7-24)13-16-5-4-8-28-16/h4-5,8-11,24H,6-7,12-13H2,1-3H3,(H,21,22)