[(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxidanylidene-propan-2-yl] 2-thiophen-2-ylcarbonylbenzoate

Systemtic Name: [(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxidanylidene-propan-2-yl] 2-thiophen-2-ylcarbonylbenzoate Openeye Name: [(1R)-2-[2-cyanoethyl(methyl)amino]-1-methyl-2-oxo-ethyl] 2-(thiophene-2-carbonyl)benzoate CAS Name: 2-[oxo(thiophen-2-yl)methyl]benzoic acid [(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxopropan-2-yl] 2-(thiophene-2-carbonyl)benzoate Traditional Name: 2-(2-thenoyl)benzoic acid [(1R)-2-[2-cyanoethyl(methyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CCC#N)OC(=O)C1=CC=CC=C1C(=O)C2=CC=CS2

Isomeric SMILES

C[C@H](C(=O)N(C)CCC#N)OC(=O)C1=CC=CC=C1C(=O)C2=CC=CS2

InChI

InChI=1S/C19H18N2O4S/c1-13(18(23)21(2)11-6-10-20)25-19(24)15-8-4-3-7-14(15)17(22)16-9-5-12-26-16/h3-5,7-9,12-13H,6,11H2,1-2H3/t13-/m1/s1