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

Systemtic Name: N-[bis(azanyl)methylidene]-4-imidazol-1-yl-2-methoxy-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-imidazol-1-yl-2-methoxy-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-(1-imidazolyl)-2-methoxy-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-imidazol-1-yl-2-methoxy-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-imidazol-1-yl-5-mesyl-2-methoxy-benzamide Formula: C13H15N5O4S MolecularWeight: 337.3543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CN=C2

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CN=C2

InChI

InChI=1S/C13H15N5O4S/c1-22-10-6-9(18-4-3-16-7-18)11(23(2,20)21)5-8(10)12(19)17-13(14)15/h3-7H,1-2H3,(H4,14,15,17,19)