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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-phenylmethoxyphenyl)-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-benzyloxyphenyl)thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-phenylmethoxyphenyl)-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-phenylmethoxyphenyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-N-piperonyl-thiazole-4-carboxamide Formula: C25H20N2O4S MolecularWeight: 444.5023

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CSC(=N3)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CSC(=N3)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H20N2O4S/c28-24(26-13-18-6-11-22-23(12-18)31-16-30-22)21-15-32-25(27-21)19-7-9-20(10-8-19)29-14-17-4-2-1-3-5-17/h1-12,15H,13-14,16H2,(H,26,28)