methyl 2-[[1,3-benzodioxol-5-ylcarbonyl(cyclopropyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[1,3-benzodioxol-5-ylcarbonyl(cyclopropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[1,3-benzodioxole-5-carbonyl(cyclopropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[1,3-benzodioxol-5-yl(oxo)methyl]-cyclopropylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[1,3-benzodioxole-5-carbonyl(cyclopropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclopropyl(piperonyloyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=N1)CN(C2CC2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CSC(=N1)CN(C2CC2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H16N2O5S/c1-22-17(21)12-8-25-15(18-12)7-19(11-3-4-11)16(20)10-2-5-13-14(6-10)24-9-23-13/h2,5-6,8,11H,3-4,7,9H2,1H3