2-(3,5-dimethylpyrazol-1-yl)-4-propan-2-ylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-4-propan-2-ylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-4-isopropylsulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-4-(propan-2-ylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-4-propan-2-ylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-4-(isopropylthio)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C18H22N4S2 MolecularWeight: 358.52408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4S2/c1-10(2)23-16-15-13-7-5-6-8-14(13)24-17(15)20-18(19-16)22-12(4)9-11(3)21-22/h9-10H,5-8H2,1-4H3