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

Systemtic Name: N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]-N-(2-methylphenyl)ethanamide Openeye Name: N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]-N-(o-tolyl)acetamide CAS Name: N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-1-piperazinyl]-N-(2-methylphenyl)acetamide IUPAC Name: N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethylpiperazin-1-yl]-N-(2-methylphenyl)acetamide Traditional Name: N-[4-(3-cyanophenyl)sulfonyl-3,5-dimethyl-piperazino]-N-(o-tolyl)acetamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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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=C3C)C(=O)C

Isomeric SMILES

CC1CN(CC(N1S(=O)(=O)C2=CC=CC(=C2)C#N)C)N(C3=CC=CC=C3C)C(=O)C

InChI

InChI=1S/C22H26N4O3S/c1-16-8-5-6-11-22(16)25(19(4)27)24-14-17(2)26(18(3)15-24)30(28,29)21-10-7-9-20(12-21)13-23/h5-12,17-18H,14-15H2,1-4H3