methyl 5-[[4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]-1-prop-2-enoxycarbonyl-pyrrolidin-2-yl]methylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: methyl 5-[[4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]-1-prop-2-enoxycarbonyl-pyrrolidin-2-yl]methylcarbamoyl]pyridine-2-carboxylate Openeye Name: methyl 5-[(1-allyloxycarbonyl-4-tert-butoxycarbonylsulfanyl-pyrrolidin-2-yl)methylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]thio]-1-[oxo(prop-2-enoxy)methyl]-2-pyrrolidinyl]methylamino]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]-1-prop-2-enoxycarbonylpyrrolidin-2-yl]methylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[1-allyloxycarbonyl-4-(tert-butoxycarbonylthio)pyrrolidin-2-yl]methylcarbamoyl]picolinic acid methyl ester Formula: C22H29N3O7S MolecularWeight: 479.54656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)SC1CC(N(C1)C(=O)OCC=C)CNC(=O)C2=CN=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)SC1CC(N(C1)C(=O)OCC=C)CNC(=O)C2=CN=C(C=C2)C(=O)OC

InChI

InChI=1S/C22H29N3O7S/c1-6-9-31-20(28)25-13-16(33-21(29)32-22(2,3)4)10-15(25)12-24-18(26)14-7-8-17(23-11-14)19(27)30-5/h6-8,11,15-16H,1,9-10,12-13H2,2-5H3,(H,24,26)