(2S,4R)-N-[(1S,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-4-(fluoren-9-ylideneamino)oxy-1-[(2R)-3-methyl-2-[oxidanyl(2-thiophen-2-ylethanoyl)amino]butanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-N-[(1S,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-4-(fluoren-9-ylideneamino)oxy-1-[(2R)-3-methyl-2-[oxidanyl(2-thiophen-2-ylethanoyl)amino]butanoyl]pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-N-[(1S,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-(fluoren-9-ylideneamino)oxy-1-[(2R)-2-[hydroxy-[2-(2-thienyl)acetyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carboxamide CAS Name: (2S,4R)-N-[(1S,2S)-1-[(cyclopropylsulfonylamino)-oxomethyl]-2-ethenylcyclopropyl]-4-(9-fluorenylideneamino)oxy-1-[(2R)-2-[hydroxy-(1-oxo-2-thiophen-2-ylethyl)amino]-3-methyl-1-oxobutyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-N-[(1S,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-4-(fluoren-9-ylideneamino)oxy-1-[(2R)-2-[hydroxy-(2-thiophen-2-ylacetyl)amino]-3-methylbutanoyl]pyrrolidine-2-carboxamide Traditional Name: (2S,4R)-N-[(1S,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-(fluoren-9-ylideneamino)oxy-1-[(2R)-2-[hydroxy-[2-(2-thienyl)acetyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carboxamide Formula: C38H41N5O8S2 MolecularWeight: 759.89084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)NS(=O)(=O)C3CC3)ON=C4C5=CC=CC=C5C6=CC=CC=C64)N(C(=O)CC7=CC=CS7)O

Isomeric SMILES

CC(C)[C@H](C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@]2(C[C@H]2C=C)C(=O)NS(=O)(=O)C3CC3)ON=C4C5=CC=CC=C5C6=CC=CC=C64)N(C(=O)CC7=CC=CS7)O

InChI

InChI=1S/C38H41N5O8S2/c1-4-23-20-38(23,37(47)41-53(49,50)26-15-16-26)39-35(45)31-18-24(51-40-33-29-13-7-5-11-27(29)28-12-6-8-14-30(28)33)21-42(31)36(46)34(22(2)3)43(48)32(44)19-25-10-9-17-52-25/h4-14,17,22-24,26,31,34,48H,1,15-16,18-21H2,2-3H3,(H,39,45)(H,41,47)/t23-,24-,31+,34-,38+/m1/s1