5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[2-(4-oxidanyl-3-oxidanylidene-2H-pyrrol-1-yl)ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[2-(4-oxidanyl-3-oxidanylidene-2H-pyrrol-1-yl)ethanoylamino]thiophene-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-hydroxy-3-oxo-2H-pyrrol-1-yl)acetyl]amino]-4-methyl-thiophene-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-hydroxy-3-oxo-2H-pyrrol-1-yl)-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-hydroxy-3-oxo-2H-pyrrol-1-yl)acetyl]amino]-4-methylthiophene-3-carboxamide Traditional Name: 2-[[2-(3-hydroxy-4-keto-2-pyrrolin-1-yl)acetyl]amino]-4-methyl-5-piperonyl-thiophene-3-carboxamide Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)CN2CC(=O)C(=C2)O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)CN2CC(=O)C(=C2)O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19N3O6S/c1-10-16(5-11-2-3-14-15(4-11)29-9-28-14)30-20(18(10)19(21)27)22-17(26)8-23-6-12(24)13(25)7-23/h2-4,6,24H,5,7-9H2,1H3,(H2,21,27)(H,22,26)