[(2S)-1-[[4-[(2S)-butan-2-yl]phenyl]amino]-1-oxidanylidene-propan-2-yl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [(2S)-1-[[4-[(2S)-butan-2-yl]phenyl]amino]-1-oxidanylidene-propan-2-yl] 5-methylpyrazine-2-carboxylate Openeye Name: [(1S)-1-methyl-2-[4-[(1S)-1-methylpropyl]anilino]-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [(2S)-1-[4-[(2S)-butan-2-yl]anilino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[4-[(2S)-butan-2-yl]anilino]-1-oxopropan-2-yl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [(1S)-2-keto-1-methyl-2-[4-[(1S)-1-methylpropyl]anilino]ethyl] ester Formula: C19H23N3O3 MolecularWeight: 341.40422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)[C@H](C)OC(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C19H23N3O3/c1-5-12(2)15-6-8-16(9-7-15)22-18(23)14(4)25-19(24)17-11-20-13(3)10-21-17/h6-12,14H,5H2,1-4H3,(H,22,23)/t12-,14-/m0/s1