N-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzothiazol-2-yl)pentanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzothiazol-2-yl)pentanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzothiazol-2-yl)pentanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzothiazol-2-yl)pentanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(1,3-benzothiazol-2-yl)pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-piperonyl-valeramide Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N2O3S/c23-19(21-12-14-9-10-16-17(11-14)25-13-24-16)7-3-4-8-20-22-15-5-1-2-6-18(15)26-20/h1-2,5-6,9-11H,3-4,7-8,12-13H2,(H,21,23)