6-(4-tert-butylphenyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]thieno[3,2-d]pyrimidine

Systemtic Name: 6-(4-tert-butylphenyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]thieno[3,2-d]pyrimidine Openeye Name: 6-(4-tert-butylphenyl)-4-[4-(p-tolylsulfonyl)piperazin-1-yl]thieno[3,2-d]pyrimidine CAS Name: 6-(4-tert-butylphenyl)-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]thieno[3,2-d]pyrimidine IUPAC Name: 6-(4-tert-butylphenyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]thieno[3,2-d]pyrimidine Traditional Name: 6-(4-tert-butylphenyl)-4-(4-tosylpiperazino)thieno[3,2-d]pyrimidine Formula: C27H30N4O2S2 MolecularWeight: 506.6827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC4=C3SC(=C4)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC4=C3SC(=C4)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C27H30N4O2S2/c1-19-5-11-22(12-6-19)35(32,33)31-15-13-30(14-16-31)26-25-23(28-18-29-26)17-24(34-25)20-7-9-21(10-8-20)27(2,3)4/h5-12,17-18H,13-16H2,1-4H3