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

Systemtic Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-butan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-sec-butyl-thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-butan-2-yl-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-butan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2,4-dimethoxybenzyl)-piperonyl-amino]methyl]-N-sec-butyl-thiazole-4-carboxamide Formula: C26H31N3O5S MolecularWeight: 497.60644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CSC(=N1)CN(CC2=CC3=C(C=C2)OCO3)CC4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CCC(C)NC(=O)C1=CSC(=N1)CN(CC2=CC3=C(C=C2)OCO3)CC4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C26H31N3O5S/c1-5-17(2)27-26(30)21-15-35-25(28-21)14-29(12-18-6-9-22-24(10-18)34-16-33-22)13-19-7-8-20(31-3)11-23(19)32-4/h6-11,15,17H,5,12-14,16H2,1-4H3,(H,27,30)