N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-piperonyl-thiazole-4-carboxamide Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H18N2O5S/c1-24-15-6-4-13(8-17(15)25-2)20-22-14(10-28-20)19(23)21-9-12-3-5-16-18(7-12)27-11-26-16/h3-8,10H,9,11H2,1-2H3,(H,21,23)