N-[bis(azanyl)methylidene]-4-(3-methoxypropylamino)-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-(3-methoxypropylamino)-3-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-(3-methoxypropylamino)-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-(3-methoxypropylamino)-3-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-(3-methoxypropylamino)-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-3-mesyl-4-(3-methoxypropylamino)benzamide Formula: C13H20N4O4S MolecularWeight: 328.3873

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

COCCCNC1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C13H20N4O4S/c1-21-7-3-6-16-10-5-4-9(12(18)17-13(14)15)8-11(10)22(2,19)20/h4-5,8,16H,3,6-7H2,1-2H3,(H4,14,15,17,18)