4-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-5-phenyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-5-phenyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-5-phenyl-thieno[2,3-d]pyrimidine CAS Name: 4-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-5-phenylthieno[2,3-d]pyrimidine IUPAC Name: 4-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-5-phenylthieno[2,3-d]pyrimidine Traditional Name: 4-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-5-phenyl-thieno[2,3-d]pyrimidine Formula: C22H18ClFN4O2S2 MolecularWeight: 488.985323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1CN(CCN1C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C22H18ClFN4O2S2/c23-18-12-16(6-7-19(18)24)32(29,30)28-10-8-27(9-11-28)21-20-17(15-4-2-1-3-5-15)13-31-22(20)26-14-25-21/h1-7,12-14H,8-11H2