sodium (1Z)-2,4-bis(chloranyl)-N-[(E)-2-pyrimidin-5-ylethenyl]sulfonyl-benzenecarboximidate

Systemtic Name: sodium (1Z)-2,4-bis(chloranyl)-N-[(E)-2-pyrimidin-5-ylethenyl]sulfonyl-benzenecarboximidate Openeye Name: sodium (1Z)-2,4-dichloro-N-[(E)-2-pyrimidin-5-ylvinyl]sulfonyl-benzenecarboximidate CAS Name: sodium (1Z)-2,4-dichloro-N-[(E)-2-(5-pyrimidinyl)ethenyl]sulfonylbenzenecarboximidate IUPAC Name: sodium (1Z)-2,4-dichloro-N-[(E)-2-pyrimidin-5-ylethenyl]sulfonylbenzenecarboximidate Traditional Name: sodium (1Z)-2,4-dichloro-N-[(E)-2-(5-pyrimidyl)vinyl]sulfonyl-benzenecarboximidate Formula: C13H8Cl2N3NaO3S MolecularWeight: 380.18169

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(=NS(=O)(=O)C=CC2=CN=CN=C2)[O-].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)/C(=N/S(=O)(=O)/C=C/C2=CN=CN=C2)/[O-].[Na+]

InChI

InChI=1S/C13H9Cl2N3O3S.Na/c14-10-1-2-11(12(15)5-10)13(19)18-22(20,21)4-3-9-6-16-8-17-7-9;/h1-8H,(H,18,19);/q;+1/p-1/b4-3+;