2-chloranyl-N-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methylsulfonyl-benzamide Openeye Name: 2-chloro-N-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methylsulfonyl-benzamide CAS Name: 2-chloro-N-[4-(4-ethyl-1-piperazinyl)phenyl]-5-methylsulfonylbenzamide IUPAC Name: 2-chloro-N-[4-(4-ethylpiperazin-1-yl)phenyl]-5-methylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-(4-ethylpiperazino)phenyl]-5-mesyl-benzamide Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-3-23-10-12-24(13-11-23)16-6-4-15(5-7-16)22-20(25)18-14-17(28(2,26)27)8-9-19(18)21/h4-9,14H,3,10-13H2,1-2H3,(H,22,25)