N-[bis(azanyl)methylidene]-2-chloranyl-5-methylsulfonyl-4-pyrimidin-5-yl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-chloranyl-5-methylsulfonyl-4-pyrimidin-5-yl-benzamide Openeye Name: 2-chloro-N-(diaminomethylene)-5-methylsulfonyl-4-pyrimidin-5-yl-benzamide CAS Name: 2-chloro-N-(diaminomethylidene)-5-methylsulfonyl-4-(5-pyrimidinyl)benzamide IUPAC Name: 2-chloro-N-(diaminomethylidene)-5-methylsulfonyl-4-pyrimidin-5-ylbenzamide Traditional Name: 2-chloro-N-(diaminomethylene)-5-mesyl-4-(5-pyrimidyl)benzamide Formula: C13H12ClN5O3S MolecularWeight: 353.78408

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1C2=CN=CN=C2)Cl)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1C2=CN=CN=C2)Cl)C(=O)N=C(N)N

InChI

InChI=1S/C13H12ClN5O3S/c1-23(21,22)11-3-9(12(20)19-13(15)16)10(14)2-8(11)7-4-17-6-18-5-7/h2-6H,1H3,(H4,15,16,19,20)