disodium [4-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]phenyl]sulfonyl-[5-(2-methylpropyl)pyrimidin-2-yl]azanide

Systemtic Name: disodium [4-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]phenyl]sulfonyl-[5-(2-methylpropyl)pyrimidin-2-yl]azanide Openeye Name: disodium [4-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]phenyl]sulfonyl-(5-isobutylpyrimidin-2-yl)azanide CAS Name: disodium [4-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]phenyl]sulfonyl-[5-(2-methylpropyl)-2-pyrimidinyl]azanide IUPAC Name: disodium [4-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]phenyl]sulfonyl-[5-(2-methylpropyl)pyrimidin-2-yl]azanide Traditional Name: disodium [4-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]phenyl]sulfonyl-(5-isobutylpyrimidin-2-yl)azanide Formula: C23H24ClN4Na2O4S+ MolecularWeight: 533.9586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CN=C(N=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)CC(=O)NC3=C(C=CC(=C3)Cl)OC.[Na+].[Na+]

Isomeric SMILES

CC(C)CC1=CN=C(N=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)CC(=O)NC3=C(C=CC(=C3)Cl)OC.[Na+].[Na+]

InChI

InChI=1S/C23H25ClN4O4S.2Na/c1-15(2)10-17-13-25-23(26-14-17)28-33(30,31)19-7-4-16(5-8-19)11-22(29)27-20-12-18(24)6-9-21(20)32-3;;/h4-9,12-15H,10-11H2,1-3H3,(H2,25,26,27,28,29);;/q;2*+1/p-1