[(2S)-1-[(3-ethoxycarbonyl-5-phenyl-thiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] furan-2-carboxylate

Systemtic Name: [(2S)-1-[(3-ethoxycarbonyl-5-phenyl-thiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] furan-2-carboxylate Openeye Name: [(1S)-2-[(3-ethoxycarbonyl-5-phenyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [(2S)-1-[(3-ethoxycarbonyl-5-phenyl-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(3-ethoxycarbonyl-5-phenylthiophen-2-yl)amino]-1-oxopropan-2-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [(1S)-2-[(3-carbethoxy-5-phenyl-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C21H19NO6S MolecularWeight: 413.44366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)OC(=O)C3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)[C@H](C)OC(=O)C3=CC=CO3

InChI

InChI=1S/C21H19NO6S/c1-3-26-20(24)15-12-17(14-8-5-4-6-9-14)29-19(15)22-18(23)13(2)28-21(25)16-10-7-11-27-16/h4-13H,3H2,1-2H3,(H,22,23)/t13-/m0/s1