N-[bis(azanyl)methylidene]-2-ethynyl-4-(4-methylimidazol-1-yl)-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethynyl-4-(4-methylimidazol-1-yl)-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-ethynyl-4-(4-methylimidazol-1-yl)-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-ethynyl-4-(4-methyl-1-imidazolyl)-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-ethynyl-4-(4-methylimidazol-1-yl)-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-ethynyl-5-mesyl-4-(4-methylimidazol-1-yl)benzamide Formula: C15H15N5O3S MolecularWeight: 345.3763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=C(C=C(C(=C2)C#C)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

CC1=CN(C=N1)C2=C(C=C(C(=C2)C#C)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C15H15N5O3S/c1-4-10-5-12(20-7-9(2)18-8-20)13(24(3,22)23)6-11(10)14(21)19-15(16)17/h1,5-8H,2-3H3,(H4,16,17,19,21)