[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluoranyl-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluoranyl-1-benzothiophen-2-yl)methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluorobenzothiophen-2-yl)methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-(4-fluoro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluoro-1-benzothiophen-2-yl)methanone Traditional Name: (4-fluorobenzothiophen-2-yl)-(4-p-phenetylsulfonylpiperazino)methanone Formula: C21H21FN2O4S2 MolecularWeight: 448.530843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C21H21FN2O4S2/c1-2-28-15-6-8-16(9-7-15)30(26,27)24-12-10-23(11-13-24)21(25)20-14-17-18(22)4-3-5-19(17)29-20/h3-9,14H,2,10-13H2,1H3