6-phenyl-4-[4-(phenylmethyl)sulfonylpiperazin-1-yl]thieno[2,3-d]pyrimidine

Systemtic Name: 6-phenyl-4-[4-(phenylmethyl)sulfonylpiperazin-1-yl]thieno[2,3-d]pyrimidine Openeye Name: 4-(4-benzylsulfonylpiperazin-1-yl)-6-phenyl-thieno[2,3-d]pyrimidine CAS Name: 6-phenyl-4-[4-(phenylmethyl)sulfonyl-1-piperazinyl]thieno[2,3-d]pyrimidine IUPAC Name: 4-(4-benzylsulfonylpiperazin-1-yl)-6-phenylthieno[2,3-d]pyrimidine Traditional Name: 4-(4-benzylsulfonylpiperazino)-6-phenyl-thieno[2,3-d]pyrimidine Formula: C23H22N4O2S2 MolecularWeight: 450.57638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=C(SC3=NC=N2)C4=CC=CC=C4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C3C=C(SC3=NC=N2)C4=CC=CC=C4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C23H22N4O2S2/c28-31(29,16-18-7-3-1-4-8-18)27-13-11-26(12-14-27)22-20-15-21(19-9-5-2-6-10-19)30-23(20)25-17-24-22/h1-10,15,17H,11-14,16H2