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

Systemtic Name: N-[2-chloranyl-4-[3-(furan-2-yl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[2-chloro-4-[3-(2-furyl)propanoylamino]phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[2-chloro-4-[[3-(2-furanyl)-1-oxopropyl]amino]phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[2-chloro-4-[3-(furan-2-yl)propanoylamino]phenyl]-3-methylsulfonylbenzamide Traditional Name: N-[2-chloro-4-[3-(2-furyl)propanoylamino]phenyl]-3-mesyl-benzamide Formula: C21H19ClN2O5S MolecularWeight: 446.90396

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)CCC3=CC=CO3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)CCC3=CC=CO3)Cl

InChI

InChI=1S/C21H19ClN2O5S/c1-30(27,28)17-6-2-4-14(12-17)21(26)24-19-9-7-15(13-18(19)22)23-20(25)10-8-16-5-3-11-29-16/h2-7,9,11-13H,8,10H2,1H3,(H,23,25)(H,24,26)