(4-ethylpiperazin-1-yl)-[1-[(2-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone

Systemtic Name: (4-ethylpiperazin-1-yl)-[1-[(2-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone Openeye Name: (4-ethylpiperazin-1-yl)-[1-(o-tolylmethylsulfonyl)-4-piperidyl]methanone CAS Name: (4-ethyl-1-piperazinyl)-[1-[(2-methylphenyl)methylsulfonyl]-4-piperidinyl]methanone IUPAC Name: (4-ethylpiperazin-1-yl)-[1-[(2-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone Traditional Name: (4-ethylpiperazino)-[1-(2-methylbenzyl)sulfonyl-4-piperidyl]methanone Formula: C20H31N3O3S MolecularWeight: 393.54344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3C

InChI

InChI=1S/C20H31N3O3S/c1-3-21-12-14-22(15-13-21)20(24)18-8-10-23(11-9-18)27(25,26)16-19-7-5-4-6-17(19)2/h4-7,18H,3,8-16H2,1-2H3