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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(3,4-dimethoxyphenyl)ethyl-[(4-methylphenyl)methyl]amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(3,4-dimethoxyphenyl)ethyl-(p-tolylmethyl)amino]methyl]thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(3,4-dimethoxyphenyl)ethyl-[(4-methylphenyl)methyl]amino]methyl]-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(3,4-dimethoxyphenyl)ethyl-[(4-methylphenyl)methyl]amino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[homoveratryl-(4-methylbenzyl)amino]methyl]-N-piperonyl-thiazole-4-carboxamide Formula: C31H33N3O5S MolecularWeight: 559.67582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC2=CC(=C(C=C2)OC)OC)CC3=NC(=CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC(=C(C=C2)OC)OC)CC3=NC(=CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C31H33N3O5S/c1-21-4-6-23(7-5-21)17-34(13-12-22-8-10-26(36-2)28(14-22)37-3)18-30-33-25(19-40-30)31(35)32-16-24-9-11-27-29(15-24)39-20-38-27/h4-11,14-15,19H,12-13,16-18,20H2,1-3H3,(H,32,35)