[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-methyl-5-methylsulfanyl-phenyl)methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-methyl-5-methylsulfanyl-phenyl)methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-methyl-5-methylsulfanyl-phenyl)methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-[2-methyl-5-(methylthio)phenyl]methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(2-methyl-5-methylsulfanylphenyl)methanone Traditional Name: [2-methyl-5-(methylthio)phenyl]-(4-p-phenetylsulfonylpiperazino)methanone Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)SC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)SC)C

InChI

InChI=1S/C21H26N2O4S2/c1-4-27-17-6-9-19(10-7-17)29(25,26)23-13-11-22(12-14-23)21(24)20-15-18(28-3)8-5-16(20)2/h5-10,15H,4,11-14H2,1-3H3