N-[2-chloranyl-4-[3-(4-ethylphenyl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[2-chloranyl-4-[3-(4-ethylphenyl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[2-chloro-4-[3-(4-ethylphenyl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[2-chloro-4-[[3-(4-ethylphenyl)-1-oxopropyl]amino]phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[2-chloro-4-[3-(4-ethylphenyl)propanoylamino]phenyl]-3-methylsulfonylbenzamide Traditional Name: N-[2-chloro-4-[3-(4-ethylphenyl)propanoylamino]phenyl]-3-mesyl-benzamide Formula: C25H25ClN2O4S MolecularWeight: 484.995

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)CCC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C25H25ClN2O4S/c1-3-17-7-9-18(10-8-17)11-14-24(29)27-20-12-13-23(22(26)16-20)28-25(30)19-5-4-6-21(15-19)33(2,31)32/h4-10,12-13,15-16H,3,11,14H2,1-2H3,(H,27,29)(H,28,30)