(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (2-methyl-5-pyrrolidin-1-ylsulfonylphenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (2-methyl-5-pyrrolidinosulfonyl-phenyl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C20H25N3O5S3 MolecularWeight: 483.6246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H25N3O5S3/c1-16-6-7-17(30(25,26)22-8-2-3-9-22)15-18(16)20(24)21-10-12-23(13-11-21)31(27,28)19-5-4-14-29-19/h4-7,14-15H,2-3,8-13H2,1H3