N-[(E)-[3-[[(2R,3R,4R,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)pyrrolidin-2-yl]methyl]-1,2,3-triazol-4-yl]methylideneamino]-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-butanamide

Systemtic Name: N-[(E)-[3-[[(2R,3R,4R,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)pyrrolidin-2-yl]methyl]-1,2,3-triazol-4-yl]methylideneamino]-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-butanamide Openeye Name: N-[(E)-[3-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl]triazol-4-yl]methyleneamino]-3-hydroxy-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[(E)-[3-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-pyrrolidinyl]methyl]-4-triazolyl]methylideneamino]-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]butanamide IUPAC Name: N-[(E)-[3-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl]triazol-4-yl]methylideneamino]-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]butanamide Traditional Name: N-[(E)-[3-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-methylol-pyrrolidin-2-yl]methyl]triazol-4-yl]methyleneamino]-3-hydroxy-2-(tosylamino)butyramide Formula: C20H29N7O7S MolecularWeight: 511.55196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)O)C(=O)NN=CC2=CN=NN2CC3C(C(C(N3)CO)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)O)C(=O)N/N=C/C2=CN=NN2C[C@@H]3[C@H]([C@@H]([C@H](N3)CO)O)O

InChI

InChI=1S/C20H29N7O7S/c1-11-3-5-14(6-4-11)35(33,34)25-17(12(2)29)20(32)24-21-7-13-8-22-26-27(13)9-15-18(30)19(31)16(10-28)23-15/h3-8,12,15-19,23,25,28-31H,9-10H2,1-2H3,(H,24,32)/b21-7+/t12?,15-,16-,17?,18-,19-/m1/s1