sodium (4-chloranyl-2-methoxy-phenyl)carbonyl-[6-(4-phenylpiperazin-1-yl)pyridin-3-yl]sulfonyl-azanide

Systemtic Name: sodium (4-chloranyl-2-methoxy-phenyl)carbonyl-[6-(4-phenylpiperazin-1-yl)pyridin-3-yl]sulfonyl-azanide Openeye Name: sodium (4-chloro-2-methoxy-benzoyl)-[[6-(4-phenylpiperazin-1-yl)-3-pyridyl]sulfonyl]azanide CAS Name: sodium [(4-chloro-2-methoxyphenyl)-oxomethyl]-[[6-(4-phenyl-1-piperazinyl)-3-pyridinyl]sulfonyl]azanide IUPAC Name: sodium (4-chloro-2-methoxybenzoyl)-[6-(4-phenylpiperazin-1-yl)pyridin-3-yl]sulfonylazanide Traditional Name: sodium (4-chloro-2-methoxy-benzoyl)-[[6-(4-phenylpiperazino)-3-pyridyl]sulfonyl]azanide Formula: C23H22ClN4NaO4S MolecularWeight: 508.95295

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)Cl)C(=O)[N-]S(=O)(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=CC=CC=C4.[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)Cl)C(=O)[N-]S(=O)(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=CC=CC=C4.[Na+]

InChI

InChI=1S/C23H23ClN4O4S.Na/c1-32-21-15-17(24)7-9-20(21)23(29)26-33(30,31)19-8-10-22(25-16-19)28-13-11-27(12-14-28)18-5-3-2-4-6-18;/h2-10,15-16H,11-14H2,1H3,(H,26,29);/q;+1/p-1