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

Systemtic Name: N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-(4-phenylmethoxyphenoxy)benzamide Openeye Name: 4-(4-benzyloxyphenoxy)-N-(diaminomethylene)-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-3-methylsulfonyl-4-(4-phenylmethoxyphenoxy)benzamide IUPAC Name: N-(diaminomethylidene)-3-methylsulfonyl-4-(4-phenylmethoxyphenoxy)benzamide Traditional Name: 4-(4-benzoxyphenoxy)-N-(diaminomethylene)-3-mesyl-benzamide Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)OC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)OC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O5S/c1-31(27,28)20-13-16(21(26)25-22(23)24)7-12-19(20)30-18-10-8-17(9-11-18)29-14-15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H4,23,24,25,26)