(3S)-5-[cyclopentylmethyl(methyl)amino]-3-[[(2S)-2-[2-[2-methoxy-5-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]ethanoylamino]-3-methyl-butanoyl]amino]-4-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-5-[cyclopentylmethyl(methyl)amino]-3-[[(2S)-2-[2-[2-methoxy-5-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]ethanoylamino]-3-methyl-butanoyl]amino]-4-oxidanylidene-pentanoic acid Openeye Name: (3S)-5-[cyclopentylmethyl(methyl)amino]-3-[[(2S)-2-[[2-[2-methoxy-5-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]acetyl]amino]-3-methyl-butanoyl]amino]-4-oxo-pentanoic acid CAS Name: (3S)-5-[cyclopentylmethyl(methyl)amino]-3-[[(2S)-2-[[2-[2-methoxy-5-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-1-oxoethyl]amino]-3-methyl-1-oxobutyl]amino]-4-oxopentanoic acid IUPAC Name: (3S)-5-[cyclopentylmethyl(methyl)amino]-3-[[(2S)-2-[[2-[2-methoxy-5-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]acetyl]amino]-3-methylbutanoyl]amino]-4-oxopentanoic acid Traditional Name: (3S)-5-[cyclopentylmethyl(methyl)amino]-4-keto-3-[[(2S)-2-[[2-[2-methoxy-5-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]acetyl]amino]-3-methyl-butanoyl]amino]valeric acid Formula: C29H41N5O7 MolecularWeight: 571.66514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2=CC(=C(C=C2)OC)CC(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)CN(C)CC3CCCC3

Isomeric SMILES

CC1=NOC(=N1)C2=CC(=C(C=C2)OC)CC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)CN(C)CC3CCCC3

InChI

InChI=1S/C29H41N5O7/c1-17(2)27(28(39)31-22(14-26(37)38)23(35)16-34(4)15-19-8-6-7-9-19)32-25(36)13-21-12-20(10-11-24(21)40-5)29-30-18(3)33-41-29/h10-12,17,19,22,27H,6-9,13-16H2,1-5H3,(H,31,39)(H,32,36)(H,37,38)/t22-,27-/m0/s1