7-butylsulfanyl-3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 7-butylsulfanyl-3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-butylsulfanyl-3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine CAS Name: 7-(butylthio)-3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine IUPAC Name: 7-butylsulfanyl-3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(butylthio)-3-(4-chlorophenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine Formula: C18H20ClN3S MolecularWeight: 345.8895

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC(=NC2=C(C(=NN12)C)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCCSC1=CC(=NC2=C(C(=NN12)C)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H20ClN3S/c1-4-5-10-23-16-11-12(2)20-18-17(13(3)21-22(16)18)14-6-8-15(19)9-7-14/h6-9,11H,4-5,10H2,1-3H3