5-(4-fluorophenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine

Systemtic Name: 5-(4-fluorophenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 5-(4-fluorophenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine CAS Name: 5-(4-fluorophenyl)-4-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]thieno[2,3-d]pyrimidine IUPAC Name: 5-(4-fluorophenyl)-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 5-(4-fluorophenyl)-4-(4-pyrrolidinosulfonylpiperazino)thieno[2,3-d]pyrimidine Formula: C20H22FN5O2S2 MolecularWeight: 447.549383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=CSC4=NC=N3)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=CSC4=NC=N3)C5=CC=C(C=C5)F

InChI

InChI=1S/C20H22FN5O2S2/c21-16-5-3-15(4-6-16)17-13-29-20-18(17)19(22-14-23-20)24-9-11-26(12-10-24)30(27,28)25-7-1-2-8-25/h3-6,13-14H,1-2,7-12H2