N-[3-(1,3-benzothiazol-2-yl)-4-ethanoyl-5-methyl-furan-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-4-ethanoyl-5-methyl-furan-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-acetyl-3-(1,3-benzothiazol-2-yl)-5-methyl-2-furyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-acetyl-3-(1,3-benzothiazol-2-yl)-5-methyl-2-furanyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-acetyl-3-(1,3-benzothiazol-2-yl)-5-methylfuran-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-acetyl-3-(1,3-benzothiazol-2-yl)-5-methyl-2-furyl]-piperonylamide Formula: C22H16N2O5S MolecularWeight: 420.43784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5S4)C(=O)C

Isomeric SMILES

CC1=C(C(=C(O1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5S4)C(=O)C

InChI

InChI=1S/C22H16N2O5S/c1-11(25)18-12(2)29-21(19(18)22-23-14-5-3-4-6-17(14)30-22)24-20(26)13-7-8-15-16(9-13)28-10-27-15/h3-9H,10H2,1-2H3,(H,24,26)