(4S)-5-(4-ethoxycarbonylpiperazin-1-yl)-4-[(4-methyl-6-phenyl-pyridin-2-yl)carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-5-(4-ethoxycarbonylpiperazin-1-yl)-4-[(4-methyl-6-phenyl-pyridin-2-yl)carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-5-(4-ethoxycarbonylpiperazin-1-yl)-4-[(4-methyl-6-phenyl-pyridine-2-carbonyl)amino]-5-oxo-pentanoic acid CAS Name: (4S)-5-(4-ethoxycarbonyl-1-piperazinyl)-4-[[(4-methyl-6-phenyl-2-pyridinyl)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: (4S)-5-(4-ethoxycarbonylpiperazin-1-yl)-4-[(4-methyl-6-phenylpyridine-2-carbonyl)amino]-5-oxopentanoic acid Traditional Name: (4S)-5-(4-carbethoxypiperazino)-5-keto-4-[(4-methyl-6-phenyl-picolinoyl)amino]valeric acid Formula: C25H30N4O6 MolecularWeight: 482.5289

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=CC(=CC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(=O)O)NC(=O)C2=CC(=CC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C25H30N4O6/c1-3-35-25(34)29-13-11-28(12-14-29)24(33)19(9-10-22(30)31)27-23(32)21-16-17(2)15-20(26-21)18-7-5-4-6-8-18/h4-8,15-16,19H,3,9-14H2,1-2H3,(H,27,32)(H,30,31)/t19-/m0/s1