4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine CAS Name: 4-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-2,5,6-trimethylthieno[2,3-d]pyrimidine IUPAC Name: 4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2,5,6-trimethylthieno[2,3-d]pyrimidine Traditional Name: 2,5,6-trimethyl-4-(4-p-phenetylsulfonylpiperazino)thieno[2,3-d]pyrimidine Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=C(SC4=NC(=N3)C)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=C(SC4=NC(=N3)C)C)C

InChI

InChI=1S/C21H26N4O3S2/c1-5-28-17-6-8-18(9-7-17)30(26,27)25-12-10-24(11-13-25)20-19-14(2)15(3)29-21(19)23-16(4)22-20/h6-9H,5,10-13H2,1-4H3