[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl]sulfanylpyridine-3-carboxylate

Systemtic Name: [1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl]sulfanylpyridine-3-carboxylate Openeye Name: [2-(isobutylamino)-1-methyl-2-oxo-ethyl] 2-[2-(isobutylamino)-1-methyl-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[1-(2-methylpropylamino)-1-oxopropan-2-yl]thio]-3-pyridinecarboxylic acid [1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylpropylamino)-1-oxopropan-2-yl] 2-[1-(2-methylpropylamino)-1-oxopropan-2-yl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-(isobutylamino)-2-keto-1-methyl-ethyl]thio]nicotinic acid [2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C1=C(N=CC=C1)SC(C)C(=O)NCC(C)C

Isomeric SMILES

CC(C)CNC(=O)C(C)OC(=O)C1=C(N=CC=C1)SC(C)C(=O)NCC(C)C

InChI

InChI=1S/C20H31N3O4S/c1-12(2)10-22-17(24)14(5)27-20(26)16-8-7-9-21-19(16)28-15(6)18(25)23-11-13(3)4/h7-9,12-15H,10-11H2,1-6H3,(H,22,24)(H,23,25)