N-(2,5-dimethylphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(2,5-dimethylphenyl)-4-(4-fluorophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(2,5-dimethylphenyl)-4-(4-fluorophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide Formula: C19H22FN3O3S MolecularWeight: 391.459683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H22FN3O3S/c1-14-3-4-15(2)18(13-14)21-19(24)22-9-11-23(12-10-22)27(25,26)17-7-5-16(20)6-8-17/h3-8,13H,9-12H2,1-2H3,(H,21,24)