[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[4-(piperidin-1-ylmethyl)phenyl]methanone

Systemtic Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[4-(piperidin-1-ylmethyl)phenyl]methanone Openeye Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[4-(1-piperidylmethyl)phenyl]methanone CAS Name: [4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-[4-(1-piperidinylmethyl)phenyl]methanone IUPAC Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[4-(piperidin-1-ylmethyl)phenyl]methanone Traditional Name: [4-(2,4-dimethylphenyl)sulfonylpiperazino]-[4-(piperidinomethyl)phenyl]methanone Formula: C25H33N3O3S MolecularWeight: 455.61282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCCC4)C

InChI

InChI=1S/C25H33N3O3S/c1-20-6-11-24(21(2)18-20)32(30,31)28-16-14-27(15-17-28)25(29)23-9-7-22(8-10-23)19-26-12-4-3-5-13-26/h6-11,18H,3-5,12-17,19H2,1-2H3