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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-thiazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-5-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-phenyl-2-veratryl-thiazole-5-carboxamide Formula: C26H22N2O5S MolecularWeight: 474.52828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC(=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC(=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5)OC

InChI

InChI=1S/C26H22N2O5S/c1-30-19-10-8-16(12-21(19)31-2)13-23-28-24(17-6-4-3-5-7-17)25(34-23)26(29)27-18-9-11-20-22(14-18)33-15-32-20/h3-12,14H,13,15H2,1-2H3,(H,27,29)