2,5-dimethyl-7-[(4-methylphenyl)methylsulfanyl]-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2,5-dimethyl-7-[(4-methylphenyl)methylsulfanyl]-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 6-benzyl-2,5-dimethyl-3-phenyl-7-(p-tolylmethylsulfanyl)pyrazolo[1,5-a]pyrimidine CAS Name: 2,5-dimethyl-7-[(4-methylphenyl)methylthio]-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 6-benzyl-2,5-dimethyl-7-[(4-methylphenyl)methylsulfanyl]-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 6-benzyl-2,5-dimethyl-7-[(4-methylbenzyl)thio]-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C29H27N3S MolecularWeight: 449.60978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=C(C(=NC3=C(C(=NN32)C)C4=CC=CC=C4)C)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=C(C(=NC3=C(C(=NN32)C)C4=CC=CC=C4)C)CC5=CC=CC=C5

InChI

InChI=1S/C29H27N3S/c1-20-14-16-24(17-15-20)19-33-29-26(18-23-10-6-4-7-11-23)21(2)30-28-27(22(3)31-32(28)29)25-12-8-5-9-13-25/h4-17H,18-19H2,1-3H3