tert-butyl N-[1-[4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-2-[[5-[(1-propylcyclopropyl)sulfonylcarbamoyl]spiro[2.2]pentan-5-yl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-2-[[5-[(1-propylcyclopropyl)sulfonylcarbamoyl]spiro[2.2]pentan-5-yl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]-2-[[5-[(1-propylcyclopropyl)sulfonylcarbamoyl]spiro[2.2]pentan-5-yl]carbamoyl]pyrrolidine-1-carbonyl]-2,2-dimethyl-propyl]carbamate CAS Name: N-[1-[4-[(7-methoxy-2-phenyl-4-quinolinyl)oxy]-2-[oxo-[[5-[oxo-[(1-propylcyclopropyl)sulfonylamino]methyl]-5-spiro[2.2]pentanyl]amino]methyl]-1-pyrrolidinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-(7-methoxy-2-phenylquinolin-4-yl)oxy-2-[[5-[(1-propylcyclopropyl)sulfonylcarbamoyl]spiro[2.2]pentan-5-yl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-[4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]-2-[[5-[(1-propylcyclopropyl)sulfonylcarbamoyl]spiro[2.2]pentan-5-yl]carbamoyl]pyrrolidine-1-carbonyl]-2,2-dimethyl-propyl]carbamic acid tert-butyl ester Formula: C44H57N5O9S MolecularWeight: 832.01648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC1)S(=O)(=O)NC(=O)C2(CC23CC3)NC(=O)C4CC(CN4C(=O)C(C(C)(C)C)NC(=O)OC(C)(C)C)OC5=CC(=NC6=C5C=CC(=C6)OC)C7=CC=CC=C7

Isomeric SMILES

CCCC1(CC1)S(=O)(=O)NC(=O)C2(CC23CC3)NC(=O)C4CC(CN4C(=O)C(C(C)(C)C)NC(=O)OC(C)(C)C)OC5=CC(=NC6=C5C=CC(=C6)OC)C7=CC=CC=C7

InChI

InChI=1S/C44H57N5O9S/c1-9-17-43(20-21-43)59(54,55)48-38(52)44(26-42(44)18-19-42)47-36(50)33-23-29(25-49(33)37(51)35(40(2,3)4)46-39(53)58-41(5,6)7)57-34-24-31(27-13-11-10-12-14-27)45-32-22-28(56-8)15-16-30(32)34/h10-16,22,24,29,33,35H,9,17-21,23,25-26H2,1-8H3,(H,46,53)(H,47,50)(H,48,52)