5-[2-[(4-imidazol-1-yl-2-methyl-butyl)amino]-1-oxidanyl-ethyl]-N-methyl-2-oxidanyl-benzamide sulfate

Systemtic Name: 5-[2-[(4-imidazol-1-yl-2-methyl-butyl)amino]-1-oxidanyl-ethyl]-N-methyl-2-oxidanyl-benzamide sulfate Openeye Name: 2-hydroxy-5-[1-hydroxy-2-[(4-imidazol-1-yl-2-methyl-butyl)amino]ethyl]-N-methyl-benzamide sulfate CAS Name: 2-hydroxy-5-[1-hydroxy-2-[[4-(1-imidazolyl)-2-methylbutyl]amino]ethyl]-N-methylbenzamide sulfate IUPAC Name: 2-hydroxy-5-[1-hydroxy-2-[(4-imidazol-1-yl-2-methylbutyl)amino]ethyl]-N-methylbenzamide sulfate Traditional Name: 2-hydroxy-5-[1-hydroxy-2-[(4-imidazol-1-yl-2-methyl-butyl)amino]ethyl]-N-methyl-benzamide sulfate Formula: C18H26N4O7S-2 MolecularWeight: 442.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=CN=C1)CNCC(C2=CC(=C(C=C2)O)C(=O)NC)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC(CCN1C=CN=C1)CNCC(C2=CC(=C(C=C2)O)C(=O)NC)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C18H26N4O3.H2O4S/c1-13(5-7-22-8-6-20-12-22)10-21-11-17(24)14-3-4-16(23)15(9-14)18(25)19-2;1-5(2,3)4/h3-4,6,8-9,12-13,17,21,23-24H,5,7,10-11H2,1-2H3,(H,19,25);(H2,1,2,3,4)/p-2