N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-pentan-3-ylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-pentan-3-ylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-4-(1-ethylpropylsulfonyl)-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-pentan-3-ylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-pentan-3-ylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-4-(1-ethylpropylsulfonyl)-5-mesyl-benzamide Formula: C16H25N3O5S2 MolecularWeight: 403.5168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)S(=O)(=O)C(CC)CC

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)S(=O)(=O)C(CC)CC

InChI

InChI=1S/C16H25N3O5S2/c1-5-10-8-14(26(23,24)11(6-2)7-3)13(25(4,21)22)9-12(10)15(20)19-16(17)18/h8-9,11H,5-7H2,1-4H3,(H4,17,18,19,20)