N-[2-chloranyl-4-[3-(1H-indol-3-yl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[2-chloranyl-4-[3-(1H-indol-3-yl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[2-chloro-4-[3-(1H-indol-3-yl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[2-chloro-4-[[3-(1H-indol-3-yl)-1-oxopropyl]amino]phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[2-chloro-4-[3-(1H-indol-3-yl)propanoylamino]phenyl]-3-methylsulfonylbenzamide Traditional Name: N-[2-chloro-4-[3-(1H-indol-3-yl)propanoylamino]phenyl]-3-mesyl-benzamide Formula: C25H22ClN3O4S MolecularWeight: 495.97788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)CCC3=CNC4=CC=CC=C43)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)CCC3=CNC4=CC=CC=C43)Cl

InChI

InChI=1S/C25H22ClN3O4S/c1-34(32,33)19-6-4-5-16(13-19)25(31)29-23-11-10-18(14-21(23)26)28-24(30)12-9-17-15-27-22-8-3-2-7-20(17)22/h2-8,10-11,13-15,27H,9,12H2,1H3,(H,28,30)(H,29,31)