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

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

Systemtic Name:N-[bis(azanyl)methylidene]-4-butylsulfonyl-3-methylsulfonyl-benzamide hydrochloride
Openeye Name:4-butylsulfonyl-N-(diaminomethylene)-3-methylsulfonyl-benzamide hydrochloride
CAS Name:4-butylsulfonyl-N-(diaminomethylidene)-3-methylsulfonylbenzamide hydrochloride
IUPAC Name:4-butylsulfonyl-N-(diaminomethylidene)-3-methylsulfonylbenzamide hydrochloride
Traditional Name:4-butylsulfonyl-N-(diaminomethylene)-3-mesyl-benzamide hydrochloride
Formula: C13H20ClN3O5S2
MolecularWeight: 397.898
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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C.Cl


Isomeric SMILES

CCCCS(=O)(=O)C1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C.Cl


InChI

InChI=1S/C13H19N3O5S2.ClH/c1-3-4-7-23(20,21)10-6-5-9(12(17)16-13(14)15)8-11(10)22(2,18)19;/h5-6,8H,3-4,7H2,1-2H3,(H4,14,15,16,17);1H


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