N-(2-chlorophenyl)-N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-1-piperazinyl]acetamide IUPAC Name: N-(2-chlorophenyl)-N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethylpiperazin-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-piperazino]acetamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1S(=O)(=O)C2=CC=CC(=C2)C#N)C)N(C3=CC=CC=C3Cl)C(=O)C

Isomeric SMILES

CC1CN(CC(N1S(=O)(=O)C2=CC=CC(=C2)C#N)C)N(C3=CC=CC=C3Cl)C(=O)C

InChI

InChI=1S/C21H23ClN4O3S/c1-15-13-24(25(17(3)27)21-10-5-4-9-20(21)22)14-16(2)26(15)30(28,29)19-8-6-7-18(11-19)12-23/h4-11,15-16H,13-14H2,1-3H3