N-[bis(azanyl)methylidene]-4-[(E)-but-2-enyl]-2-methyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-[(E)-but-2-enyl]-2-methyl-5-methylsulfonyl-benzamide Openeye Name: 4-[(E)-but-2-enyl]-N-(diaminomethylene)-2-methyl-5-methylsulfonyl-benzamide CAS Name: 4-[(E)-but-2-enyl]-N-(diaminomethylidene)-2-methyl-5-methylsulfonylbenzamide IUPAC Name: 4-[(E)-but-2-enyl]-N-(diaminomethylidene)-2-methyl-5-methylsulfonylbenzamide Traditional Name: 4-[(E)-but-2-enyl]-N-(diaminomethylene)-5-mesyl-2-methyl-benzamide Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC1=C(C=C(C(=C1)C)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

C/C=C/CC1=C(C=C(C(=C1)C)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C14H19N3O3S/c1-4-5-6-10-7-9(2)11(13(18)17-14(15)16)8-12(10)21(3,19)20/h4-5,7-8H,6H2,1-3H3,(H4,15,16,17,18)/b5-4+