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

Systemtic Name: (4-methylpiperazin-1-yl)-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: (4-methylpiperazin-1-yl)-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidyl]methanone CAS Name: (4-methyl-1-piperazinyl)-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: (1-mesitylsulfonyl-4-piperidyl)-(4-methylpiperazino)methanone Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O3S/c1-15-13-16(2)19(17(3)14-15)27(25,26)23-7-5-18(6-8-23)20(24)22-11-9-21(4)10-12-22/h13-14,18H,5-12H2,1-4H3