N-[bis(azanyl)methylidene]-4-[4-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-[4-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]-3-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-[4-(3-methyl-2-oxo-benzimidazol-1-yl)-1-piperidyl]-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-[4-(3-methyl-2-oxo-1-benzimidazolyl)-1-piperidinyl]-3-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-[4-(3-methyl-2-oxobenzimidazol-1-yl)piperidin-1-yl]-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-[4-(2-keto-3-methyl-benzimidazol-1-yl)piperidino]-3-mesyl-benzamide Formula: C22H26N6O4S MolecularWeight: 470.54464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)C3CCN(CC3)C4=C(C=C(C=C4)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)C3CCN(CC3)C4=C(C=C(C=C4)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C22H26N6O4S/c1-26-16-5-3-4-6-17(16)28(22(26)30)15-9-11-27(12-10-15)18-8-7-14(20(29)25-21(23)24)13-19(18)33(2,31)32/h3-8,13,15H,9-12H2,1-2H3,(H4,23,24,25,29)