4-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-[(2R)-4-phenylbutan-2-yl]piperazine-1-carboxamide

Systemtic Name: 4-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-[(2R)-4-phenylbutan-2-yl]piperazine-1-carboxamide Openeye Name: 4-(2,5-difluorophenyl)sulfonyl-N-[(1R)-1-methyl-3-phenyl-propyl]piperazine-1-carboxamide CAS Name: 4-(2,5-difluorophenyl)sulfonyl-N-[(2R)-4-phenylbutan-2-yl]-1-piperazinecarboxamide IUPAC Name: 4-(2,5-difluorophenyl)sulfonyl-N-[(2R)-4-phenylbutan-2-yl]piperazine-1-carboxamide Traditional Name: 4-(2,5-difluorophenyl)sulfonyl-N-[(1R)-1-methyl-3-phenyl-propyl]piperazine-1-carboxamide Formula: C21H25F2N3O3S MolecularWeight: 437.503306

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C21H25F2N3O3S/c1-16(7-8-17-5-3-2-4-6-17)24-21(27)25-11-13-26(14-12-25)30(28,29)20-15-18(22)9-10-19(20)23/h2-6,9-10,15-16H,7-8,11-14H2,1H3,(H,24,27)/t16-/m1/s1