N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[(4-chlorophenyl)-cyclopropylmethyl]-4-(3-fluorophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(4-chlorophenyl)-cyclopropylmethyl]-4-(3-fluorophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carboxamide Formula: C21H23ClFN3O3S MolecularWeight: 451.942023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=C(C=C2)Cl)NC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CC1C(C2=CC=C(C=C2)Cl)NC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C21H23ClFN3O3S/c22-17-8-6-16(7-9-17)20(15-4-5-15)24-21(27)25-10-12-26(13-11-25)30(28,29)19-3-1-2-18(23)14-19/h1-3,6-9,14-15,20H,4-5,10-13H2,(H,24,27)