[(2R)-1-[(diphenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [(2R)-1-[(diphenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [(1R)-2-(benzhydrylamino)-1-methyl-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [(2R)-1-[(diphenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(benzhydrylamino)-1-oxopropan-2-yl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [(1R)-2-(benzhydrylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H22N2O3S MolecularWeight: 406.49738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O3S/c1-16(28-23(27)19-14-9-15-24-22(19)29-2)21(26)25-20(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-16,20H,1-2H3,(H,25,26)/t16-/m1/s1