1-(4-fluorophenyl)carbonyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[4-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[4-[4-(2-methoxyphenyl)piperazino]sulfonylphenyl]isonipecotamide Formula: C30H33FN4O5S MolecularWeight: 580.670223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C30H33FN4O5S/c1-40-28-5-3-2-4-27(28)33-18-20-35(21-19-33)41(38,39)26-12-10-25(11-13-26)32-29(36)22-14-16-34(17-15-22)30(37)23-6-8-24(31)9-7-23/h2-13,22H,14-21H2,1H3,(H,32,36)