(4-phenylpiperazin-1-yl)-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: (4-phenylpiperazin-1-yl)-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: (4-phenylpiperazin-1-yl)-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidyl]methanone CAS Name: (4-phenyl-1-piperazinyl)-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: (4-phenylpiperazin-1-yl)-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: (1-mesitylsulfonyl-4-piperidyl)-(4-phenylpiperazino)methanone Formula: C25H33N3O3S MolecularWeight: 455.61282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H33N3O3S/c1-19-17-20(2)24(21(3)18-19)32(30,31)28-11-9-22(10-12-28)25(29)27-15-13-26(14-16-27)23-7-5-4-6-8-23/h4-8,17-18,22H,9-16H2,1-3H3