5-(4-methoxyphenyl)-4-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]thieno[2,3-d]pyrimidine

Systemtic Name: 5-(4-methoxyphenyl)-4-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]thieno[2,3-d]pyrimidine Openeye Name: 5-(4-methoxyphenyl)-4-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]thieno[2,3-d]pyrimidine CAS Name: 5-(4-methoxyphenyl)-4-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]thieno[2,3-d]pyrimidine IUPAC Name: 5-(4-methoxyphenyl)-4-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]thieno[2,3-d]pyrimidine Traditional Name: 5-(4-methoxyphenyl)-4-[4-(2-nitrophenyl)sulfonylpiperazino]thieno[2,3-d]pyrimidine Formula: C23H21N5O5S2 MolecularWeight: 511.57334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O5S2/c1-33-17-8-6-16(7-9-17)18-14-34-23-21(18)22(24-15-25-23)26-10-12-27(13-11-26)35(31,32)20-5-3-2-4-19(20)28(29)30/h2-9,14-15H,10-13H2,1H3