4-[[3-chloranyl-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]-2-fluoranyl-3-phenyl-benzamide

Systemtic Name: 4-[[3-chloranyl-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]-2-fluoranyl-3-phenyl-benzamide Openeye Name: 4-[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]-2-fluoro-3-phenyl-benzamide CAS Name: 4-[[[[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]thio]amino]-oxomethyl]amino]-2-fluoro-3-phenylbenzamide IUPAC Name: 4-[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]-2-fluoro-3-phenylbenzamide Traditional Name: 4-[[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]thio]carbamoylamino]-2-fluoro-3-phenyl-benzamide Formula: C27H28ClFN4O2S MolecularWeight: 527.053223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=C(C=C(C=C2)SNC(=O)NC3=C(C(=C(C=C3)C(=O)N)F)C4=CC=CC=C4)Cl

Isomeric SMILES

CN(C1CCCCC1)C2=C(C=C(C=C2)SNC(=O)NC3=C(C(=C(C=C3)C(=O)N)F)C4=CC=CC=C4)Cl

InChI

InChI=1S/C27H28ClFN4O2S/c1-33(18-10-6-3-7-11-18)23-15-12-19(16-21(23)28)36-32-27(35)31-22-14-13-20(26(30)34)25(29)24(22)17-8-4-2-5-9-17/h2,4-5,8-9,12-16,18H,3,6-7,10-11H2,1H3,(H2,30,34)(H2,31,32,35)