[(2R)-1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 3-methylbenzo[g][1]benzofuran-2-carboxylate

Systemtic Name: [(2R)-1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 3-methylbenzo[g][1]benzofuran-2-carboxylate Openeye Name: [(1R)-2-[(3-cyano-2-thienyl)amino]-1-methyl-2-oxo-ethyl] 3-methylbenzo[g]benzofuran-2-carboxylate CAS Name: 3-methyl-2-benzo[g]benzofurancarboxylic 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] 3-methylbenzo[g][1]benzofuran-2-carboxylate Traditional Name: 3-methylbenzo[g]benzofuran-2-carboxylic acid [(1R)-2-[(3-cyano-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C22H16N2O4S MolecularWeight: 404.43844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC3=CC=CC=C32)C(=O)OC(C)C(=O)NC4=C(C=CS4)C#N

Isomeric SMILES

CC1=C(OC2=C1C=CC3=CC=CC=C32)C(=O)O[C@H](C)C(=O)NC4=C(C=CS4)C#N

InChI

InChI=1S/C22H16N2O4S/c1-12-16-8-7-14-5-3-4-6-17(14)19(16)28-18(12)22(26)27-13(2)20(25)24-21-15(11-23)9-10-29-21/h3-10,13H,1-2H3,(H,24,25)/t13-/m1/s1