N-[1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[1-(3-fluoro-4-methoxy-phenyl)ethyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[1-(3-fluoro-4-methoxy-phenyl)ethyl]-4-mesitylsulfonyl-piperazine-1-carboxamide Formula: C23H30FN3O4S MolecularWeight: 463.565403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30FN3O4S/c1-15-12-16(2)22(17(3)13-15)32(29,30)27-10-8-26(9-11-27)23(28)25-18(4)19-6-7-21(31-5)20(24)14-19/h6-7,12-14,18H,8-11H2,1-5H3,(H,25,28)