methyl (2R)-2-[[(2S,3S)-1-(furan-2-ylcarbonyl)-3-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidin-2-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2R)-2-[[(2S,3S)-1-(furan-2-ylcarbonyl)-3-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidin-2-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl (2R)-2-[[(2S,3S)-1-(furan-2-carbonyl)-3-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carbonyl]amino]-3-methyl-butanoate CAS Name: (2R)-2-[[[(2S,3S)-1-[2-furanyl(oxo)methyl]-3-[[[3-(methylthio)anilino]-oxomethyl]amino]-2-pyrrolidinyl]-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2S,3S)-1-(furan-2-carbonyl)-3-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carbonyl]amino]-3-methylbutanoate Traditional Name: (2R)-2-[[(2S,3S)-1-(2-furoyl)-3-[[3-(methylthio)phenyl]carbamoylamino]prolyl]amino]-3-methyl-butyric acid methyl ester Formula: C24H30N4O6S MolecularWeight: 502.5832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1C(CCN1C(=O)C2=CC=CO2)NC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC(C)[C@H](C(=O)OC)NC(=O)[C@@H]1[C@H](CCN1C(=O)C2=CC=CO2)NC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C24H30N4O6S/c1-14(2)19(23(31)33-3)27-21(29)20-17(10-11-28(20)22(30)18-9-6-12-34-18)26-24(32)25-15-7-5-8-16(13-15)35-4/h5-9,12-14,17,19-20H,10-11H2,1-4H3,(H,27,29)(H2,25,26,32)/t17-,19+,20-/m0/s1