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

Systemtic Name: (3-chloranyl-5-ethoxy-4-propoxy-phenyl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-chloro-5-ethoxy-4-propoxy-phenyl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone CAS Name: (3-chloro-5-ethoxy-4-propoxyphenyl)-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-5-ethoxy-4-propoxyphenyl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-chloro-5-ethoxy-4-propoxy-phenyl)-(4-pyrrolidinosulfonylpiperazino)methanone Formula: C20H30ClN3O5S MolecularWeight: 459.9873

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3)OCC

InChI

InChI=1S/C20H30ClN3O5S/c1-3-13-29-19-17(21)14-16(15-18(19)28-4-2)20(25)22-9-11-24(12-10-22)30(26,27)23-7-5-6-8-23/h14-15H,3-13H2,1-2H3