N-[bis(azanyl)methylidene]-4-[1-(4-fluorophenyl)carbonylpiperidin-4-yl]-2-methyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-[1-(4-fluorophenyl)carbonylpiperidin-4-yl]-2-methyl-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-[1-(4-fluorobenzoyl)-4-piperidyl]-2-methyl-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-[1-[(4-fluorophenyl)-oxomethyl]-4-piperidinyl]-2-methyl-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-[1-(4-fluorobenzoyl)piperidin-4-yl]-2-methyl-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-[1-(4-fluorobenzoyl)-4-piperidyl]-5-mesyl-2-methyl-benzamide Formula: C22H25FN4O4S MolecularWeight: 460.521703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN4O4S/c1-13-11-18(19(32(2,30)31)12-17(13)20(28)26-22(24)25)14-7-9-27(10-8-14)21(29)15-3-5-16(23)6-4-15/h3-6,11-12,14H,7-10H2,1-2H3,(H4,24,25,26,28)