(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C18H14N2O5S2 MolecularWeight: 402.44416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C18H14N2O5S2/c21-16(23-7-13-9-27-18(20-13)12-3-4-26-8-12)6-19-17(22)11-1-2-14-15(5-11)25-10-24-14/h1-5,8-9H,6-7,10H2,(H,19,22)