N-[2-chloranyl-4-[4-(2,6-dimethylphenyl)piperazin-1-yl]sulfonyl-phenyl]ethanamide

Systemtic Name: N-[2-chloranyl-4-[4-(2,6-dimethylphenyl)piperazin-1-yl]sulfonyl-phenyl]ethanamide Openeye Name: N-[2-chloro-4-[4-(2,6-dimethylphenyl)piperazin-1-yl]sulfonyl-phenyl]acetamide CAS Name: N-[2-chloro-4-[[4-(2,6-dimethylphenyl)-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[2-chloro-4-[4-(2,6-dimethylphenyl)piperazin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[2-chloro-4-[4-(2,6-dimethylphenyl)piperazino]sulfonyl-phenyl]acetamide Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)NC(=O)C)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)NC(=O)C)Cl

InChI

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