2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(phenylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(phenylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-benzyl-thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-(phenylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxol-5-ylmethyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]methyl]-N-benzyl-1,3-thiazole-4-carboxamide Traditional Name: N-benzyl-2-[[homoveratryl(piperonyl)amino]methyl]thiazole-4-carboxamide Formula: C30H31N3O5S MolecularWeight: 545.64924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)NCC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)NCC5=CC=CC=C5)OC

InChI

InChI=1S/C30H31N3O5S/c1-35-25-10-8-21(14-27(25)36-2)12-13-33(17-23-9-11-26-28(15-23)38-20-37-26)18-29-32-24(19-39-29)30(34)31-16-22-6-4-3-5-7-22/h3-11,14-15,19H,12-13,16-18,20H2,1-2H3,(H,31,34)