2-[4,5-dimethyl-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[4,5-dimethyl-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[4,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 2-[[4,5-dimethyl-1-(2-oxolanylmethyl)-2-imidazolyl]thio]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[4,5-dimethyl-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[[4,5-dimethyl-1-(tetrahydrofurfuryl)imidazol-2-yl]thio]ethanone Formula: C23H32N4O4S2 MolecularWeight: 492.65458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)CC4CCCO4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)CC4CCCO4)C

InChI

InChI=1S/C23H32N4O4S2/c1-18-19(2)27(15-21-9-6-14-31-21)23(24-18)32-16-22(28)25-10-12-26(13-11-25)33(29,30)17-20-7-4-3-5-8-20/h3-5,7-8,21H,6,9-17H2,1-2H3