N-(2,4-dimethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(2,4-dimethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(2,4-dimethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(2,4-dimethoxyphenyl)-4-(4-fluorophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(2,4-dimethoxyphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide Formula: C19H22FN3O5S MolecularWeight: 423.458483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22FN3O5S/c1-27-15-5-8-17(18(13-15)28-2)21-19(24)22-9-11-23(12-10-22)29(25,26)16-6-3-14(20)4-7-16/h3-8,13H,9-12H2,1-2H3,(H,21,24)