[3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone

Systemtic Name: [3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Openeye Name: [3-(cyclohexylsulfanylmethyl)benzofuran-2-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone CAS Name: [3-[(cyclohexylthio)methyl]-2-benzofuranyl]-[4-(2,3-dimethylphenyl)-1-piperazinyl]methanone IUPAC Name: [3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Traditional Name: [3-[(cyclohexylthio)methyl]benzofuran-2-yl]-[4-(2,3-dimethylphenyl)piperazino]methanone Formula: C28H34N2O2S MolecularWeight: 462.64676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4O3)CSC5CCCCC5)C

InChI

InChI=1S/C28H34N2O2S/c1-20-9-8-13-25(21(20)2)29-15-17-30(18-16-29)28(31)27-24(19-33-22-10-4-3-5-11-22)23-12-6-7-14-26(23)32-27/h6-9,12-14,22H,3-5,10-11,15-19H2,1-2H3