methyl 5-[[2-(3-methylbut-2-enoylamino)-4-phenyl-thiophen-3-yl]carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[2-(3-methylbut-2-enoylamino)-4-phenyl-thiophen-3-yl]carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[2-(3-methylbut-2-enoylamino)-4-phenyl-thiophene-3-carbonyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[[2-[(3-methyl-1-oxobut-2-enyl)amino]-4-phenyl-3-thiophenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(3-methylbut-2-enoylamino)-4-phenylthiophene-3-carbonyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[2-(3-methylbut-2-enoylamino)-4-phenyl-thiophene-3-carbonyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C23H21NO6S MolecularWeight: 439.48094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC3=CC=C(O3)C(=O)OC)C

Isomeric SMILES

CC(=CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC3=CC=C(O3)C(=O)OC)C

InChI

InChI=1S/C23H21NO6S/c1-14(2)11-19(25)24-21-20(17(13-31-21)15-7-5-4-6-8-15)23(27)29-12-16-9-10-18(30-16)22(26)28-3/h4-11,13H,12H2,1-3H3,(H,24,25)