5,6-dimethyl-4-[4-(phenylsulfonyl)piperazin-1-yl]-2-propan-2-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-4-[4-(phenylsulfonyl)piperazin-1-yl]-2-propan-2-yl-thieno[2,3-d]pyrimidine Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidine CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-5,6-dimethyl-2-propan-2-ylthieno[2,3-d]pyrimidine IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-5,6-dimethyl-2-propan-2-ylthieno[2,3-d]pyrimidine Traditional Name: 4-(4-besylpiperazino)-2-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidine Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C(C)C)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C(C)C)C

InChI

InChI=1S/C21H26N4O2S2/c1-14(2)19-22-20(18-15(3)16(4)28-21(18)23-19)24-10-12-25(13-11-24)29(26,27)17-8-6-5-7-9-17/h5-9,14H,10-13H2,1-4H3