methyl (3R)-3-[2-[3-[4-[(Z)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]ethanoylamino]-5-pyridin-3-yl-pentanoate

Systemtic Name: methyl (3R)-3-[2-[3-[4-[(Z)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]ethanoylamino]-5-pyridin-3-yl-pentanoate Openeye Name: methyl (3R)-3-[[2-[3-[4-[(Z)-N'-tert-butoxycarbonylcarbamimidoyl]phenyl]-4,5-dihydroisoxazol-5-yl]acetyl]amino]-5-(3-pyridyl)pentanoate CAS Name: (3R)-3-[[2-[3-[4-[(Z)-amino-[(2-methylpropan-2-yl)oxy-oxomethyl]iminomethyl]phenyl]-4,5-dihydroisoxazol-5-yl]-1-oxoethyl]amino]-5-(3-pyridinyl)pentanoic acid methyl ester IUPAC Name: methyl (3R)-3-[[2-[3-[4-[(Z)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-5-pyridin-3-ylpentanoate Traditional Name: (3R)-3-[[2-[3-[4-[(Z)-N'-tert-butoxycarbonylamidino]phenyl]-2-isoxazolin-5-yl]acetyl]amino]-5-(3-pyridyl)valeric acid methyl ester Formula: C28H35N5O6 MolecularWeight: 537.6074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(C1=CC=C(C=C1)C2=NOC(C2)CC(=O)NC(CCC3=CN=CC=C3)CC(=O)OC)N

Isomeric SMILES

CC(C)(C)OC(=O)/N=C(/C1=CC=C(C=C1)C2=NOC(C2)CC(=O)N[C@H](CCC3=CN=CC=C3)CC(=O)OC)\N

InChI

InChI=1S/C28H35N5O6/c1-28(2,3)38-27(36)32-26(29)20-10-8-19(9-11-20)23-15-22(39-33-23)16-24(34)31-21(14-25(35)37-4)12-7-18-6-5-13-30-17-18/h5-6,8-11,13,17,21-22H,7,12,14-16H2,1-4H3,(H,31,34)(H2,29,32,36)/t21-,22?/m1/s1