1-(2,5-dimethylphenyl)-4-(3-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(2,5-dimethylphenyl)-4-(3-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazine Openeye Name: 1-(2,5-dimethylphenyl)-4-(3-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-piperazine CAS Name: 1-(2,5-dimethylphenyl)-4-[3-(1-pyrrolidinylsulfonyl)phenyl]sulfonylpiperazine IUPAC Name: 1-(2,5-dimethylphenyl)-4-(3-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperazine Traditional Name: 1-(2,5-dimethylphenyl)-4-(3-pyrrolidinosulfonylphenyl)sulfonyl-piperazine Formula: C22H29N3O4S2 MolecularWeight: 463.61336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H29N3O4S2/c1-18-8-9-19(2)22(16-18)23-12-14-25(15-13-23)31(28,29)21-7-5-6-20(17-21)30(26,27)24-10-3-4-11-24/h5-9,16-17H,3-4,10-15H2,1-2H3