N-(3-chloranyl-2-methyl-phenyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(3-chloro-2-methyl-phenyl)acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(3-chloro-2-methylphenyl)acetamide Traditional Name: 2-(4-benzylsulfonylpiperazino)-N-(3-chloro-2-methyl-phenyl)acetamide Formula: C20H24ClN3O3S MolecularWeight: 421.94086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H24ClN3O3S/c1-16-18(21)8-5-9-19(16)22-20(25)14-23-10-12-24(13-11-23)28(26,27)15-17-6-3-2-4-7-17/h2-9H,10-15H2,1H3,(H,22,25)