N-[bis(azanyl)methylidene]-4-butan-2-yl-3-methylsulfonyl-benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-butan-2-yl-3-methylsulfonyl-benzamide hydrochloride Openeye Name: N-(diaminomethylene)-3-methylsulfonyl-4-sec-butyl-benzamide hydrochloride CAS Name: 4-butan-2-yl-N-(diaminomethylidene)-3-methylsulfonylbenzamide hydrochloride IUPAC Name: 4-butan-2-yl-N-(diaminomethylidene)-3-methylsulfonylbenzamide hydrochloride Traditional Name: N-(diaminomethylene)-3-mesyl-4-sec-butyl-benzamide hydrochloride Formula: C13H20ClN3O3S MolecularWeight: 333.8342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3S.ClH/c1-4-8(2)10-6-5-9(12(17)16-13(14)15)7-11(10)20(3,18)19;/h5-8H,4H2,1-3H3,(H4,14,15,16,17);1H