2,6-dimethyl-5-phenyl-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine

Systemtic Name: 2,6-dimethyl-5-phenyl-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 2,6-dimethyl-5-phenyl-4-[4-(2-thienylsulfonyl)piperazin-1-yl]thieno[2,3-d]pyrimidine CAS Name: 2,6-dimethyl-5-phenyl-4-(4-thiophen-2-ylsulfonyl-1-piperazinyl)thieno[2,3-d]pyrimidine IUPAC Name: 2,6-dimethyl-5-phenyl-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 2,6-dimethyl-5-phenyl-4-[4-(2-thienylsulfonyl)piperazino]thieno[2,3-d]pyrimidine Formula: C22H22N4O2S3 MolecularWeight: 470.63068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=C(N=C2S1)C)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N=C(N=C2S1)C)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C22H22N4O2S3/c1-15-19(17-7-4-3-5-8-17)20-21(23-16(2)24-22(20)30-15)25-10-12-26(13-11-25)31(27,28)18-9-6-14-29-18/h3-9,14H,10-13H2,1-2H3