[(2R)-1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: [(2R)-1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)ethanoate Openeye Name: [(1R)-2-[(3-cyano-2-thienyl)amino]-1-methyl-2-oxo-ethyl] 2-(6-ethylbenzofuran-3-yl)acetate CAS Name: 2-(6-ethyl-3-benzofuranyl)acetic acid [(2R)-1-[(3-cyano-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[(3-cyanothiophen-2-yl)amino]-1-oxopropan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-ethylbenzofuran-3-yl)acetic acid [(1R)-2-[(3-cyano-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)OC(C)C(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)O[C@H](C)C(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C20H18N2O4S/c1-3-13-4-5-16-15(11-25-17(16)8-13)9-18(23)26-12(2)19(24)22-20-14(10-21)6-7-27-20/h4-8,11-12H,3,9H2,1-2H3,(H,22,24)/t12-/m1/s1