(phenylmethyl) N-[1-[2-[[(2S)-1-(5-butyl-1,3,4-oxadiazol-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethyl]-2-(4-fluorophenyl)-6-oxidanylidene-pyrimidin-5-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-[[(2S)-1-(5-butyl-1,3,4-oxadiazol-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethyl]-2-(4-fluorophenyl)-6-oxidanylidene-pyrimidin-5-yl]carbamate Openeye Name: benzyl N-[1-[2-[[(1S)-1-(5-butyl-1,3,4-oxadiazole-2-carbonyl)-2-methyl-propyl]amino]-2-oxo-ethyl]-2-(4-fluorophenyl)-6-oxo-pyrimidin-5-yl]carbamate CAS Name: N-[1-[2-[[(2S)-1-(5-butyl-1,3,4-oxadiazol-2-yl)-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-2-(4-fluorophenyl)-6-oxo-5-pyrimidinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-[[(2S)-1-(5-butyl-1,3,4-oxadiazol-2-yl)-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-2-(4-fluorophenyl)-6-oxopyrimidin-5-yl]carbamate Traditional Name: N-[1-[2-[[(1S)-1-(5-butyl-1,3,4-oxadiazole-2-carbonyl)-2-methyl-propyl]amino]-2-keto-ethyl]-2-(4-fluorophenyl)-6-keto-pyrimidin-5-yl]carbamic acid benzyl ester Formula: C31H33FN6O6 MolecularWeight: 604.628723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(O1)C(=O)C(C(C)C)NC(=O)CN2C(=NC=C(C2=O)NC(=O)OCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCCCC1=NN=C(O1)C(=O)[C@H](C(C)C)NC(=O)CN2C(=NC=C(C2=O)NC(=O)OCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C31H33FN6O6/c1-4-5-11-25-36-37-29(44-25)27(40)26(19(2)3)35-24(39)17-38-28(21-12-14-22(32)15-13-21)33-16-23(30(38)41)34-31(42)43-18-20-9-7-6-8-10-20/h6-10,12-16,19,26H,4-5,11,17-18H2,1-3H3,(H,34,42)(H,35,39)/t26-/m0/s1