ethyl 2-[[(2S)-5-azanyl-2-[[(2S)-4-methyl-2-[[(2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]pentanoyl]amino]pentanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[(2S)-5-azanyl-2-[[(2S)-4-methyl-2-[[(2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]pentanoyl]amino]pentanoyl]amino]ethanoate Openeye Name: ethyl 2-[[(2S)-5-amino-2-[[(2S)-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]pentanoyl]amino]acetate CAS Name: 2-[[(2S)-5-amino-2-[[(2S)-4-methyl-2-[[(2R)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]-1-oxopentyl]amino]-1-oxopentyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(2S)-5-amino-2-[[(2S)-4-methyl-2-[[(2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]pentanoyl]amino]pentanoyl]amino]acetate Traditional Name: 2-[[(2S)-5-amino-2-[[(2S)-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]pentanoyl]amino]acetic acid ethyl ester Formula: C25H47N5O7 MolecularWeight: 529.66998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(CCCN)NC(=O)C(CC(C)C)NC(=O)C(C(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CNC(=O)[C@H](CCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H47N5O7/c1-9-36-19(31)14-27-21(32)17(11-10-12-26)28-22(33)18(13-15(2)3)29-23(34)20(16(4)5)30-24(35)37-25(6,7)8/h15-18,20H,9-14,26H2,1-8H3,(H,27,32)(H,28,33)(H,29,34)(H,30,35)/t17-,18-,20+/m0/s1