[(3S)-1-[(5-fluoranyl-2-methyl-phenyl)carbamoyl]-4,4-dimethyl-pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate

Systemtic Name: [(3S)-1-[(5-fluoranyl-2-methyl-phenyl)carbamoyl]-4,4-dimethyl-pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Openeye Name: [(3S)-1-[(5-fluoro-2-methyl-phenyl)carbamoyl]-4,4-dimethyl-pyrrolidin-3-yl] N-[(1S)-1-[2-oxo-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamate CAS Name: N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamic acid [(3S)-1-[(5-fluoro-2-methylanilino)-oxomethyl]-4,4-dimethyl-3-pyrrolidinyl] ester IUPAC Name: [(3S)-1-[(5-fluoro-2-methylphenyl)carbamoyl]-4,4-dimethylpyrrolidin-3-yl] N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Traditional Name: N-[(1S)-1-[2-keto-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamic acid [(3S)-1-[(5-fluoro-2-methyl-phenyl)carbamoyl]-4,4-dimethyl-pyrrolidin-3-yl] ester Formula: C30H39FN4O5 MolecularWeight: 554.652863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=O)NC(C)C1=CC=CC=C1)NC(=O)OC2CN(CC2(C)C)C(=O)NC3=C(C=CC(=C3)F)C

Isomeric SMILES

CCCC[C@@H](C(=O)C(=O)N[C@H](C)C1=CC=CC=C1)NC(=O)O[C@@H]2CN(CC2(C)C)C(=O)NC3=C(C=CC(=C3)F)C

InChI

InChI=1S/C30H39FN4O5/c1-6-7-13-23(26(36)27(37)32-20(3)21-11-9-8-10-12-21)34-29(39)40-25-17-35(18-30(25,4)5)28(38)33-24-16-22(31)15-14-19(24)2/h8-12,14-16,20,23,25H,6-7,13,17-18H2,1-5H3,(H,32,37)(H,33,38)(H,34,39)/t20-,23+,25-/m1/s1