(4-butoxy-3-ethoxy-phenyl)-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-butoxy-3-ethoxy-phenyl)-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-butoxy-3-ethoxy-phenyl)-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]methanone CAS Name: (4-butoxy-3-ethoxyphenyl)-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: (4-butoxy-3-ethoxyphenyl)-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-butoxy-3-ethoxy-phenyl)-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]methanone Formula: C22H30N2O5S2 MolecularWeight: 466.614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C)OCC

InChI

InChI=1S/C22H30N2O5S2/c1-4-6-15-29-19-9-8-18(16-20(19)28-5-2)22(25)23-11-13-24(14-12-23)31(26,27)21-10-7-17(3)30-21/h7-10,16H,4-6,11-15H2,1-3H3