[4-fluoranyl-3-(phenoxymethyl)-1-benzothiophen-2-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-fluoranyl-3-(phenoxymethyl)-1-benzothiophen-2-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-fluoro-3-(phenoxymethyl)benzothiophen-2-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-fluoro-3-(phenoxymethyl)-1-benzothiophen-2-yl]-[4-(3-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [4-fluoro-3-(phenoxymethyl)-1-benzothiophen-2-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-fluoro-3-(phenoxymethyl)benzothiophen-2-yl]-[4-(3-methoxyphenyl)piperazino]methanone Formula: C27H25FN2O3S MolecularWeight: 476.562403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=C(C4=C(C=CC=C4S3)F)COC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=C(C4=C(C=CC=C4S3)F)COC5=CC=CC=C5

InChI

InChI=1S/C27H25FN2O3S/c1-32-21-10-5-7-19(17-21)29-13-15-30(16-14-29)27(31)26-22(18-33-20-8-3-2-4-9-20)25-23(28)11-6-12-24(25)34-26/h2-12,17H,13-16,18H2,1H3