[4-(4-fluorophenyl)piperazin-1-yl]-(3-methoxy-4-phenylmethoxy-phenyl)methanethione

Systemtic Name: [4-(4-fluorophenyl)piperazin-1-yl]-(3-methoxy-4-phenylmethoxy-phenyl)methanethione Openeye Name: (4-benzyloxy-3-methoxy-phenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanethione CAS Name: [4-(4-fluorophenyl)-1-piperazinyl]-(3-methoxy-4-phenylmethoxyphenyl)methanethione IUPAC Name: [4-(4-fluorophenyl)piperazin-1-yl]-(3-methoxy-4-phenylmethoxyphenyl)methanethione Traditional Name: (4-benzoxy-3-methoxy-phenyl)-[4-(4-fluorophenyl)piperazino]methanethione Formula: C25H25FN2O2S MolecularWeight: 436.541603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)N2CCN(CC2)C3=CC=C(C=C3)F)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)N2CCN(CC2)C3=CC=C(C=C3)F)OCC4=CC=CC=C4

InChI

InChI=1S/C25H25FN2O2S/c1-29-24-17-20(7-12-23(24)30-18-19-5-3-2-4-6-19)25(31)28-15-13-27(14-16-28)22-10-8-21(26)9-11-22/h2-12,17H,13-16,18H2,1H3