[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-phenyl-4-thiophen-2-yl-1,3-thiazol-5-yl)ethanoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-phenyl-4-thiophen-2-yl-1,3-thiazol-5-yl)ethanoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl] 2-[2-phenyl-4-(2-thienyl)thiazol-5-yl]acetate CAS Name: 2-(2-phenyl-4-thiophen-2-yl-5-thiazolyl)acetic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(2-phenyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetate Traditional Name: 2-[2-phenyl-4-(2-thienyl)thiazol-5-yl]acetic acid [2-keto-2-(piperonylamino)ethyl] ester Formula: C25H20N2O5S2 MolecularWeight: 492.5667

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)CC3=C(N=C(S3)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)CC3=C(N=C(S3)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C25H20N2O5S2/c28-22(26-13-16-8-9-18-19(11-16)32-15-31-18)14-30-23(29)12-21-24(20-7-4-10-33-20)27-25(34-21)17-5-2-1-3-6-17/h1-11H,12-15H2,(H,26,28)