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

Systemtic Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclopropyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclopropyl-thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclopropyl-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclopropyl-1,3-thiazole-4-carboxamide Traditional Name: N-cyclopropyl-2-[[(2,4-dimethoxybenzyl)-piperonyl-amino]methyl]thiazole-4-carboxamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)NC5CC5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)NC5CC5)OC

InChI

InChI=1S/C25H27N3O5S/c1-30-19-7-4-17(22(10-19)31-2)12-28(11-16-3-8-21-23(9-16)33-15-32-21)13-24-27-20(14-34-24)25(29)26-18-5-6-18/h3-4,7-10,14,18H,5-6,11-13,15H2,1-2H3,(H,26,29)