[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone

Systemtic Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone CAS Name: [4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-[3-[(methylthio)methyl]phenyl]methanone IUPAC Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone Traditional Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazino]-[3-[(methylthio)methyl]phenyl]methanone Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)CSC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)CSC

InChI

InChI=1S/C21H26N2O5S2/c1-27-18-7-8-19(28-2)20(14-18)30(25,26)23-11-9-22(10-12-23)21(24)17-6-4-5-16(13-17)15-29-3/h4-8,13-14H,9-12,15H2,1-3H3