N-[bis(azanyl)methylidene]-2-methyl-5-methylsulfonyl-4-phenylmethoxy-benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-2-methyl-5-methylsulfonyl-4-phenylmethoxy-benzamide hydrochloride Openeye Name: 4-benzyloxy-N-(diaminomethylene)-2-methyl-5-methylsulfonyl-benzamide hydrochloride CAS Name: N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-4-phenylmethoxybenzamide hydrochloride IUPAC Name: N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-4-phenylmethoxybenzamide hydrochloride Traditional Name: 4-benzoxy-N-(diaminomethylene)-5-mesyl-2-methyl-benzamide hydrochloride Formula: C17H20ClN3O4S MolecularWeight: 397.8764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)OCC2=CC=CC=C2.Cl

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)OCC2=CC=CC=C2.Cl

InChI

InChI=1S/C17H19N3O4S.ClH/c1-11-8-14(24-10-12-6-4-3-5-7-12)15(25(2,22)23)9-13(11)16(21)20-17(18)19;/h3-9H,10H2,1-2H3,(H4,18,19,20,21);1H