N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]benzamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)butanoylamino]-N-piperonyl-benzamide Formula: C26H23N3O4S MolecularWeight: 473.54352

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CCCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CCCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H23N3O4S/c30-24(10-5-11-25-29-20-8-3-4-9-23(20)34-25)28-19-7-2-1-6-18(19)26(31)27-15-17-12-13-21-22(14-17)33-16-32-21/h1-4,6-9,12-14H,5,10-11,15-16H2,(H,27,31)(H,28,30)