N-[bis(azanyl)methylidene]-2-butyl-4-(4-methylphenyl)-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-butyl-4-(4-methylphenyl)-5-methylsulfonyl-benzamide Openeye Name: 2-butyl-N-(diaminomethylene)-5-methylsulfonyl-4-(p-tolyl)benzamide CAS Name: 2-butyl-N-(diaminomethylidene)-4-(4-methylphenyl)-5-methylsulfonylbenzamide IUPAC Name: 2-butyl-N-(diaminomethylidene)-4-(4-methylphenyl)-5-methylsulfonylbenzamide Traditional Name: 2-butyl-N-(diaminomethylene)-5-mesyl-4-(p-tolyl)benzamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)C)C(=O)N=C(N)N

Isomeric SMILES

CCCCC1=C(C=C(C(=C1)C2=CC=C(C=C2)C)S(=O)(=O)C)C(=O)N=C(N)N

InChI

InChI=1S/C20H25N3O3S/c1-4-5-6-15-11-16(14-9-7-13(2)8-10-14)18(27(3,25)26)12-17(15)19(24)23-20(21)22/h7-12H,4-6H2,1-3H3,(H4,21,22,23,24)