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

Systemtic Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclohexyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclohexyl-thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclohexyl-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-N-cyclohexyl-1,3-thiazole-4-carboxamide Traditional Name: N-cyclohexyl-2-[[(2,4-dimethoxybenzyl)-piperonyl-amino]methyl]thiazole-4-carboxamide Formula: C28H33N3O5S MolecularWeight: 523.64372

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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)NC5CCCCC5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)NC5CCCCC5)OC

InChI

InChI=1S/C28H33N3O5S/c1-33-22-10-9-20(25(13-22)34-2)15-31(14-19-8-11-24-26(12-19)36-18-35-24)16-27-30-23(17-37-27)28(32)29-21-6-4-3-5-7-21/h8-13,17,21H,3-7,14-16,18H2,1-2H3,(H,29,32)