(4R)-N-[(1R,2R)-2-[bis(fluoranyl)methyl]-1-(cyclopropylsulfonylcarbamoyl)cyclopropyl]-1-[(2S)-3,3-dimethyl-2-(phenacylamino)butanoyl]-4-[5-(4-methoxyphenyl)-1,2,3,4-tetrazol-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: (4R)-N-[(1R,2R)-2-[bis(fluoranyl)methyl]-1-(cyclopropylsulfonylcarbamoyl)cyclopropyl]-1-[(2S)-3,3-dimethyl-2-(phenacylamino)butanoyl]-4-[5-(4-methoxyphenyl)-1,2,3,4-tetrazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: (4R)-N-[(1R,2R)-1-(cyclopropylsulfonylcarbamoyl)-2-(difluoromethyl)cyclopropyl]-1-[(2S)-3,3-dimethyl-2-(phenacylamino)butanoyl]-4-[5-(4-methoxyphenyl)tetrazol-2-yl]pyrrolidine-2-carboxamide CAS Name: (4R)-N-[(1R,2R)-1-[(cyclopropylsulfonylamino)-oxomethyl]-2-(difluoromethyl)cyclopropyl]-1-[(2S)-3,3-dimethyl-1-oxo-2-(phenacylamino)butyl]-4-[5-(4-methoxyphenyl)-2-tetrazolyl]-2-pyrrolidinecarboxamide IUPAC Name: (4R)-N-[(1R,2R)-1-(cyclopropylsulfonylcarbamoyl)-2-(difluoromethyl)cyclopropyl]-1-[(2S)-3,3-dimethyl-2-(phenacylamino)butanoyl]-4-[5-(4-methoxyphenyl)tetrazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: (4R)-N-[(1R,2R)-1-(cyclopropylsulfonylcarbamoyl)-2-(difluoromethyl)cyclopropyl]-1-[(2S)-3,3-dimethyl-2-(phenacylamino)butanoyl]-4-[5-(4-methoxyphenyl)tetrazol-2-yl]pyrrolidine-2-carboxamide Formula: C35H42F2N8O7S MolecularWeight: 756.819186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC(CC1C(=O)NC2(CC2C(F)F)C(=O)NS(=O)(=O)C3CC3)N4N=C(N=N4)C5=CC=C(C=C5)OC)NCC(=O)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)N1C[C@@H](CC1C(=O)N[C@@]2(C[C@H]2C(F)F)C(=O)NS(=O)(=O)C3CC3)N4N=C(N=N4)C5=CC=C(C=C5)OC)NCC(=O)C6=CC=CC=C6

InChI

InChI=1S/C35H42F2N8O7S/c1-34(2,3)28(38-18-27(46)20-8-6-5-7-9-20)32(48)44-19-22(45-41-30(40-43-45)21-10-12-23(52-4)13-11-21)16-26(44)31(47)39-35(17-25(35)29(36)37)33(49)42-53(50,51)24-14-15-24/h5-13,22,24-26,28-29,38H,14-19H2,1-4H3,(H,39,47)(H,42,49)/t22-,25+,26?,28-,35-/m1/s1