methyl 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]carbonylthiophene-2-carboxylate

Systemtic Name: methyl 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]carbonylthiophene-2-carboxylate Openeye Name: methyl 5-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]thiophene-2-carboxylate CAS Name: 5-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]thiophene-2-carboxylate Traditional Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]thiophene-2-carboxylic acid methyl ester Formula: C24H22F2N2O3S MolecularWeight: 456.504886

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H22F2N2O3S/c1-31-24(30)21-11-10-20(32-21)23(29)28-14-12-27(13-15-28)22(16-2-6-18(25)7-3-16)17-4-8-19(26)9-5-17/h2-11,22H,12-15H2,1H3