(2S,4R)-1-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-bis(oxidanylidene)hexan-3-yl]-4-(2-cyclopropyl-7-methoxy-quinolin-4-yl)oxy-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-1-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-bis(oxidanylidene)hexan-3-yl]-4-(2-cyclopropyl-7-methoxy-quinolin-4-yl)oxy-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-1-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-N-[(1S)-1-[2-(cyclopropylamino)-2-oxo-acetyl]butyl]-4-[(2-cyclopropyl-7-methoxy-4-quinolyl)oxy]pyrrolidine-2-carboxamide CAS Name: (2S,4R)-1-[(2S)-2-[[(tert-butylamino)-oxomethyl]amino]-3,3-dimethyl-1-oxobutyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-4-[(2-cyclopropyl-7-methoxy-4-quinolinyl)oxy]-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-1-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-4-(2-cyclopropyl-7-methoxyquinolin-4-yl)oxypyrrolidine-2-carboxamide Traditional Name: (2S,4R)-1-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-N-[(1S)-1-[2-(cyclopropylamino)-2-keto-acetyl]butyl]-4-[(2-cyclopropyl-7-methoxy-4-quinolyl)oxy]pyrrolidine-2-carboxamide Formula: C38H54N6O7 MolecularWeight: 706.87136

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(=O)NC1CC1)NC(=O)C2CC(CN2C(=O)C(C(C)(C)C)NC(=O)NC(C)(C)C)OC3=CC(=NC4=C3C=CC(=C4)OC)C5CC5

Isomeric SMILES

CCC[C@@H](C(=O)C(=O)NC1CC1)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](C(C)(C)C)NC(=O)NC(C)(C)C)OC3=CC(=NC4=C3C=CC(=C4)OC)C5CC5

InChI

InChI=1S/C38H54N6O7/c1-9-10-26(31(45)34(47)39-22-13-14-22)41-33(46)29-18-24(20-44(29)35(48)32(37(2,3)4)42-36(49)43-38(5,6)7)51-30-19-27(21-11-12-21)40-28-17-23(50-8)15-16-25(28)30/h15-17,19,21-22,24,26,29,32H,9-14,18,20H2,1-8H3,(H,39,47)(H,41,46)(H2,42,43,49)/t24-,26+,29+,32-/m1/s1