tert-butyl N-[(2R)-1-[(2S,5R)-2-[[2-ethenyl-1-[[methyl(propan-2-yl)sulfamoyl]carbamoyl]cyclopropyl]carbamoyl]-5-(7-methoxyquinolin-4-yl)oxy-pyrrolidin-1-yl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[(2S,5R)-2-[[2-ethenyl-1-[[methyl(propan-2-yl)sulfamoyl]carbamoyl]cyclopropyl]carbamoyl]-5-(7-methoxyquinolin-4-yl)oxy-pyrrolidin-1-yl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-[(2S,5R)-2-[[1-[[isopropyl(methyl)sulfamoyl]carbamoyl]-2-vinyl-cyclopropyl]carbamoyl]-5-[(7-methoxy-4-quinolyl)oxy]pyrrolidine-1-carbonyl]-2,2-dimethyl-propyl]carbamate CAS Name: N-[(2R)-1-[(2S,5R)-2-[[[2-ethenyl-1-[[[methyl(propan-2-yl)sulfamoyl]amino]-oxomethyl]cyclopropyl]amino]-oxomethyl]-5-[(7-methoxy-4-quinolinyl)oxy]-1-pyrrolidinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-[(2S,5R)-2-[[2-ethenyl-1-[[methyl(propan-2-yl)sulfamoyl]carbamoyl]cyclopropyl]carbamoyl]-5-(7-methoxyquinolin-4-yl)oxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1R)-1-[(2S,5R)-2-[[1-[[isopropyl(methyl)sulfamoyl]carbamoyl]-2-vinyl-cyclopropyl]carbamoyl]-5-[(7-methoxy-4-quinolyl)oxy]pyrrolidine-1-carbonyl]-2,2-dimethyl-propyl]carbamic acid tert-butyl ester Formula: C36H52N6O9S MolecularWeight: 744.89788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)S(=O)(=O)NC(=O)C1(CC1C=C)NC(=O)C2CCC(N2C(=O)C(C(C)(C)C)NC(=O)OC(C)(C)C)OC3=C4C=CC(=CC4=NC=C3)OC

Isomeric SMILES

CC(C)N(C)S(=O)(=O)NC(=O)C1(CC1C=C)NC(=O)[C@@H]2CC[C@H](N2C(=O)[C@@H](C(C)(C)C)NC(=O)OC(C)(C)C)OC3=C4C=CC(=CC4=NC=C3)OC

InChI

InChI=1S/C36H52N6O9S/c1-12-22-20-36(22,32(45)40-52(47,48)41(10)21(2)3)39-30(43)26-15-16-28(50-27-17-18-37-25-19-23(49-11)13-14-24(25)27)42(26)31(44)29(34(4,5)6)38-33(46)51-35(7,8)9/h12-14,17-19,21-22,26,28-29H,1,15-16,20H2,2-11H3,(H,38,46)(H,39,43)(H,40,45)/t22?,26-,28+,29-,36?/m0/s1