N-[bis(azanyl)methylidene]-4-(butylamino)-3-chloranyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-(butylamino)-3-chloranyl-5-methylsulfonyl-benzamide Openeye Name: 4-(butylamino)-3-chloro-N-(diaminomethylene)-5-methylsulfonyl-benzamide CAS Name: 4-(butylamino)-3-chloro-N-(diaminomethylidene)-5-methylsulfonylbenzamide IUPAC Name: 4-(butylamino)-3-chloro-N-(diaminomethylidene)-5-methylsulfonylbenzamide Traditional Name: 4-(butylamino)-3-chloro-N-(diaminomethylene)-5-mesyl-benzamide Formula: C13H19ClN4O3S MolecularWeight: 346.83296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1Cl)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

CCCCNC1=C(C=C(C=C1Cl)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C13H19ClN4O3S/c1-3-4-5-17-11-9(14)6-8(12(19)18-13(15)16)7-10(11)22(2,20)21/h6-7,17H,3-5H2,1-2H3,(H4,15,16,18,19)