4-chloranyl-5,6-dimethyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)thieno[2,3-d]pyrimidine

Systemtic Name: 4-chloranyl-5,6-dimethyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)thieno[2,3-d]pyrimidine Openeye Name: 4-chloro-5,6-dimethyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)thieno[2,3-d]pyrimidine CAS Name: 4-chloro-5,6-dimethyl-2-[(1H-1,2,4-triazol-5-ylthio)methyl]thieno[2,3-d]pyrimidine IUPAC Name: 4-chloro-5,6-dimethyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)thieno[2,3-d]pyrimidine Traditional Name: 4-chloro-5,6-dimethyl-2-[(1H-1,2,4-triazol-5-ylthio)methyl]thieno[2,3-d]pyrimidine Formula: C11H10ClN5S2 MolecularWeight: 311.8136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)CSC3=NC=NN3)Cl)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)CSC3=NC=NN3)Cl)C

InChI

InChI=1S/C11H10ClN5S2/c1-5-6(2)19-10-8(5)9(12)15-7(16-10)3-18-11-13-4-14-17-11/h4H,3H2,1-2H3,(H,13,14,17)