N-[bis(azanyl)methylidene]-4-(1-methoxypropan-2-yl)-3-methylsulfonyl-benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-(1-methoxypropan-2-yl)-3-methylsulfonyl-benzamide hydrochloride Openeye Name: N-(diaminomethylene)-4-(2-methoxy-1-methyl-ethyl)-3-methylsulfonyl-benzamide hydrochloride CAS Name: N-(diaminomethylidene)-4-(1-methoxypropan-2-yl)-3-methylsulfonylbenzamide hydrochloride IUPAC Name: N-(diaminomethylidene)-4-(1-methoxypropan-2-yl)-3-methylsulfonylbenzamide hydrochloride Traditional Name: N-(diaminomethylene)-3-mesyl-4-(2-methoxy-1-methyl-ethyl)benzamide hydrochloride Formula: C13H20ClN3O4S MolecularWeight: 349.8336

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)C1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C.Cl

Isomeric SMILES

CC(COC)C1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C.Cl

InChI

InChI=1S/C13H19N3O4S.ClH/c1-8(7-20-2)10-5-4-9(12(17)16-13(14)15)6-11(10)21(3,18)19;/h4-6,8H,7H2,1-3H3,(H4,14,15,16,17);1H