[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate

Systemtic Name: [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate Openeye Name: [(1R)-2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate CAS Name: 4-methyl-5-thieno[3,2-b]pyrrolecarboxylic acid [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-methylthieno[3,2-b]pyrrole-5-carboxylic acid [(1R)-2-keto-1-methyl-2-(piperonylamino)ethyl] ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC4=C(N3C)C=CS4

Isomeric SMILES

C[C@H](C(=O)NCC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC4=C(N3C)C=CS4

InChI

InChI=1S/C19H18N2O5S/c1-11(26-19(23)14-8-17-13(21(14)2)5-6-27-17)18(22)20-9-12-3-4-15-16(7-12)25-10-24-15/h3-8,11H,9-10H2,1-2H3,(H,20,22)/t11-/m1/s1