2-pyridin-3-yl-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine

Systemtic Name: 2-pyridin-3-yl-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 2-(3-pyridyl)-4-[4-(2-thienylsulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 2-(3-pyridinyl)-4-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 2-pyridin-3-yl-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 2-(3-pyridyl)-4-[4-(2-thienylsulfonyl)piperazino]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C23H23N5O2S3 MolecularWeight: 497.65602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N=C(N=C3S2)C4=CN=CC=C4)N5CCN(CC5)S(=O)(=O)C6=CC=CS6

Isomeric SMILES

C1CCC2=C(C1)C3=C(N=C(N=C3S2)C4=CN=CC=C4)N5CCN(CC5)S(=O)(=O)C6=CC=CS6

InChI

InChI=1S/C23H23N5O2S3/c29-33(30,19-8-4-14-31-19)28-12-10-27(11-13-28)22-20-17-6-1-2-7-18(17)32-23(20)26-21(25-22)16-5-3-9-24-15-16/h3-5,8-9,14-15H,1-2,6-7,10-13H2