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

Systemtic Name: N-[bis(azanyl)methylidene]-2-butyl-5-methylsulfonyl-4-phenyl-benzamide Openeye Name: 2-butyl-N-(diaminomethylene)-5-methylsulfonyl-4-phenyl-benzamide CAS Name: 2-butyl-N-(diaminomethylidene)-5-methylsulfonyl-4-phenylbenzamide IUPAC Name: 2-butyl-N-(diaminomethylidene)-5-methylsulfonyl-4-phenylbenzamide Traditional Name: 2-butyl-N-(diaminomethylene)-5-mesyl-4-phenyl-benzamide Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O3S/c1-3-4-8-14-11-15(13-9-6-5-7-10-13)17(26(2,24)25)12-16(14)18(23)22-19(20)21/h5-7,9-12H,3-4,8H2,1-2H3,(H4,20,21,22,23)