[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 2,3-dithiophen-2-ylprop-2-enoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl] 2,3-bis(2-thienyl)prop-2-enoate CAS Name: 2,3-dithiophen-2-yl-2-propenoic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dithiophen-2-ylprop-2-enoate Traditional Name: 2,3-bis(2-thienyl)acrylic acid [2-keto-2-(piperonylamino)ethyl] ester Formula: C21H17NO5S2 MolecularWeight: 427.49338

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C(=CC3=CC=CS3)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C(=CC3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H17NO5S2/c23-20(22-11-14-5-6-17-18(9-14)27-13-26-17)12-25-21(24)16(19-4-2-8-29-19)10-15-3-1-7-28-15/h1-10H,11-13H2,(H,22,23)