ethyl (2S)-2-acetamido-5-[2-[(5-butylpyridin-2-yl)carbonylamino]ethylamino]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl (2S)-2-acetamido-5-[2-[(5-butylpyridin-2-yl)carbonylamino]ethylamino]-5-oxidanylidene-pentanoate Openeye Name: ethyl (2S)-2-acetamido-5-[2-[(5-butylpyridine-2-carbonyl)amino]ethylamino]-5-oxo-pentanoate CAS Name: (2S)-2-acetamido-5-[2-[[(5-butyl-2-pyridinyl)-oxomethyl]amino]ethylamino]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-acetamido-5-[2-[(5-butylpyridine-2-carbonyl)amino]ethylamino]-5-oxopentanoate Traditional Name: (2S)-2-acetamido-5-[2-[(5-butylpicolinoyl)amino]ethylamino]-5-keto-valeric acid ethyl ester Formula: C21H32N4O5 MolecularWeight: 420.50258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=C1)C(=O)NCCNC(=O)CCC(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCCCC1=CN=C(C=C1)C(=O)NCCNC(=O)CC[C@@H](C(=O)OCC)NC(=O)C

InChI

InChI=1S/C21H32N4O5/c1-4-6-7-16-8-9-17(24-14-16)20(28)23-13-12-22-19(27)11-10-18(25-15(3)26)21(29)30-5-2/h8-9,14,18H,4-7,10-13H2,1-3H3,(H,22,27)(H,23,28)(H,25,26)/t18-/m0/s1