(3-chloranyl-5-ethoxy-4-propoxy-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (3-chloranyl-5-ethoxy-4-propoxy-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-chloro-5-ethoxy-4-propoxy-phenyl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-chloro-5-ethoxy-4-propoxyphenyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (3-chloro-5-ethoxy-4-propoxyphenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-chloro-5-ethoxy-4-propoxy-phenyl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C20H25ClN2O5S2 MolecularWeight: 473.0059

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)OCC

InChI

InChI=1S/C20H25ClN2O5S2/c1-3-11-28-19-16(21)13-15(14-17(19)27-4-2)20(24)22-7-9-23(10-8-22)30(25,26)18-6-5-12-29-18/h5-6,12-14H,3-4,7-11H2,1-2H3