N-[bis(azanyl)methylidene]-2-ethyl-4-imidazol-1-yl-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-4-imidazol-1-yl-3-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-4-imidazol-1-yl-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-4-(1-imidazolyl)-3-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-4-imidazol-1-yl-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-4-imidazol-1-yl-3-mesyl-benzamide Formula: C14H17N5O3S MolecularWeight: 335.38148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1S(=O)(=O)C)N2C=CN=C2)C(=O)N=C(N)N

Isomeric SMILES

CCC1=C(C=CC(=C1S(=O)(=O)C)N2C=CN=C2)C(=O)N=C(N)N

InChI

InChI=1S/C14H17N5O3S/c1-3-9-10(13(20)18-14(15)16)4-5-11(12(9)23(2,21)22)19-7-6-17-8-19/h4-8H,3H2,1-2H3,(H4,15,16,18,20)