N-[bis(azanyl)methylidene]-2-methyl-3-methylsulfonyl-4-propyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-methyl-3-methylsulfonyl-4-propyl-benzamide Openeye Name: N-(diaminomethylene)-2-methyl-3-methylsulfonyl-4-propyl-benzamide CAS Name: N-(diaminomethylidene)-2-methyl-3-methylsulfonyl-4-propylbenzamide IUPAC Name: N-(diaminomethylidene)-2-methyl-3-methylsulfonyl-4-propylbenzamide Traditional Name: N-(diaminomethylene)-3-mesyl-2-methyl-4-propyl-benzamide Formula: C13H19N3O3S MolecularWeight: 297.37326

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C=C1)C(=O)N=C(N)N)C)S(=O)(=O)C

Isomeric SMILES

CCCC1=C(C(=C(C=C1)C(=O)N=C(N)N)C)S(=O)(=O)C

InChI

InChI=1S/C13H19N3O3S/c1-4-5-9-6-7-10(12(17)16-13(14)15)8(2)11(9)20(3,18)19/h6-7H,4-5H2,1-3H3,(H4,14,15,16,17)