[5-[(4-bromophenyl)sulfinylmethyl]furan-2-yl]-(4-cyclohexylpiperazin-1-yl)methanone

Systemtic Name: [5-[(4-bromophenyl)sulfinylmethyl]furan-2-yl]-(4-cyclohexylpiperazin-1-yl)methanone Openeye Name: [5-[(4-bromophenyl)sulfinylmethyl]-2-furyl]-(4-cyclohexylpiperazin-1-yl)methanone CAS Name: [5-[(4-bromophenyl)sulfinylmethyl]-2-furanyl]-(4-cyclohexyl-1-piperazinyl)methanone IUPAC Name: [5-[(4-bromophenyl)sulfinylmethyl]furan-2-yl]-(4-cyclohexylpiperazin-1-yl)methanone Traditional Name: [5-[(4-bromophenyl)sulfinylmethyl]-2-furyl]-(4-cyclohexylpiperazino)methanone Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CC=C(O3)CS(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CC=C(O3)CS(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H27BrN2O3S/c23-17-6-9-20(10-7-17)29(27)16-19-8-11-21(28-19)22(26)25-14-12-24(13-15-25)18-4-2-1-3-5-18/h6-11,18H,1-5,12-16H2