(E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-N-cyclopentyl-prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-N-cyclopentyl-prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-N-cyclopentyl-prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-N-cyclopentyl-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-N-cyclopentylprop-2-enamide Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-N-cyclopentyl-N-piperonyl-acrylamide Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C=CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)/C=C/C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H22N2O3S/c26-23(12-11-22-24-18-7-3-4-8-21(18)29-22)25(17-5-1-2-6-17)14-16-9-10-19-20(13-16)28-15-27-19/h3-4,7-13,17H,1-2,5-6,14-15H2/b12-11+