N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]benzofuran-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-2-benzofurancarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-(4-methyl-5-piperonyl-thiazol-2-yl)coumarilamide Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC3=CC=CC=C3O2)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC3=CC=CC=C3O2)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H16N2O4S/c1-12-19(9-13-6-7-16-17(8-13)26-11-25-16)28-21(22-12)23-20(24)18-10-14-4-2-3-5-15(14)27-18/h2-8,10H,9,11H2,1H3,(H,22,23,24)