4-[2-[[2-(3,5-dimethylpyrazol-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]sulfanyl]ethyl]morpholine

Systemtic Name: 4-[2-[[2-(3,5-dimethylpyrazol-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]sulfanyl]ethyl]morpholine Openeye Name: 4-[2-[[2-(3,5-dimethylpyrazol-1-yl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]sulfanyl]ethyl]morpholine CAS Name: 4-[2-[[2-(3,5-dimethyl-1-pyrazolyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]thio]ethyl]morpholine IUPAC Name: 4-[2-[[2-(3,5-dimethylpyrazol-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]sulfanyl]ethyl]morpholine Traditional Name: 4-[2-[[2-(3,5-dimethylpyrazol-1-yl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]thio]ethyl]morpholine Formula: C21H27N5OS2 MolecularWeight: 429.60198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=C(C4=C(S3)CCCC4)C(=N2)SCCN5CCOCC5)C

Isomeric SMILES

CC1=CC(=NN1C2=NC3=C(C4=C(S3)CCCC4)C(=N2)SCCN5CCOCC5)C

InChI

InChI=1S/C21H27N5OS2/c1-14-13-15(2)26(24-14)21-22-19(28-12-9-25-7-10-27-11-8-25)18-16-5-3-4-6-17(16)29-20(18)23-21/h13H,3-12H2,1-2H3