N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-pyrazol-1-yl-benzamide Openeye Name: N-(diaminomethylene)-3-methylsulfonyl-4-pyrazol-1-yl-benzamide CAS Name: N-(diaminomethylidene)-3-methylsulfonyl-4-(1-pyrazolyl)benzamide IUPAC Name: N-(diaminomethylidene)-3-methylsulfonyl-4-pyrazol-1-ylbenzamide Traditional Name: N-(diaminomethylene)-3-mesyl-4-pyrazol-1-yl-benzamide Formula: C12H13N5O3S MolecularWeight: 307.32832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)N2C=CC=N2

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)N2C=CC=N2

InChI

InChI=1S/C12H13N5O3S/c1-21(19,20)10-7-8(11(18)16-12(13)14)3-4-9(10)17-6-2-5-15-17/h2-7H,1H3,(H4,13,14,16,18)