[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluoranyl-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluoranyl-1-benzothiophen-2-yl)methanone Openeye Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluorobenzothiophen-2-yl)methanone CAS Name: [4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-(4-fluoro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(4-fluoro-1-benzothiophen-2-yl)methanone Traditional Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-(4-fluorobenzothiophen-2-yl)methanone Formula: C21H21FN2O5S2 MolecularWeight: 464.530243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=CC=C4S3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=CC=C4S3)F)OC

InChI

InChI=1S/C21H21FN2O5S2/c1-28-17-7-6-14(12-18(17)29-2)31(26,27)24-10-8-23(9-11-24)21(25)20-13-15-16(22)4-3-5-19(15)30-20/h3-7,12-13H,8-11H2,1-2H3