2-methyl-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 2-methyl-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidine Openeye Name: 2-methyl-4-[4-[(E)-styryl]sulfonylpiperazin-1-yl]-5-(2-thienyl)thieno[2,3-d]pyrimidine CAS Name: 2-methyl-4-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-5-thiophen-2-ylthieno[2,3-d]pyrimidine IUPAC Name: 2-methyl-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-5-thiophen-2-ylthieno[2,3-d]pyrimidine Traditional Name: 2-methyl-4-[4-[(E)-styryl]sulfonylpiperazino]-5-(2-thienyl)thieno[2,3-d]pyrimidine Formula: C23H22N4O2S3 MolecularWeight: 482.64138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CCN(CC4)S(=O)(=O)C=CC5=CC=CC=C5

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CCN(CC4)S(=O)(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C23H22N4O2S3/c1-17-24-22(21-19(16-31-23(21)25-17)20-8-5-14-30-20)26-10-12-27(13-11-26)32(28,29)15-9-18-6-3-2-4-7-18/h2-9,14-16H,10-13H2,1H3/b15-9+