N-[bis(azanyl)methylidene]-4-[(E)-but-2-en-2-yl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-[(E)-but-2-en-2-yl]-3-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-[(E)-1-methylprop-1-enyl]-3-methylsulfonyl-benzamide CAS Name: 4-[(E)-but-2-en-2-yl]-N-(diaminomethylidene)-3-methylsulfonylbenzamide IUPAC Name: 4-[(E)-but-2-en-2-yl]-N-(diaminomethylidene)-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-3-mesyl-4-[(E)-1-methylprop-1-enyl]benzamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3S/c1-4-8(2)10-6-5-9(12(17)16-13(14)15)7-11(10)20(3,18)19/h4-7H,1-3H3,(H4,14,15,16,17)/b8-4+