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

Systemtic Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-hexyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-hexyl-thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-hexyl-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-hexyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2,4-dimethoxybenzyl)-piperonyl-amino]methyl]-N-hexyl-thiazole-4-carboxamide Formula: C28H35N3O5S MolecularWeight: 525.6596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O5S/c1-4-5-6-7-12-29-28(32)23-18-37-27(30-23)17-31(15-20-8-11-24-26(13-20)36-19-35-24)16-21-9-10-22(33-2)14-25(21)34-3/h8-11,13-14,18H,4-7,12,15-17,19H2,1-3H3,(H,29,32)