2-[4-[(4-chlorophenyl)methylsulfanyl]-3,5-dimethyl-pyrazol-1-yl]-4-pyridin-2-yl-pyrimidine

Systemtic Name: 2-[4-[(4-chlorophenyl)methylsulfanyl]-3,5-dimethyl-pyrazol-1-yl]-4-pyridin-2-yl-pyrimidine Openeye Name: 2-[4-[(4-chlorophenyl)methylsulfanyl]-3,5-dimethyl-pyrazol-1-yl]-4-(2-pyridyl)pyrimidine CAS Name: 2-[4-[(4-chlorophenyl)methylthio]-3,5-dimethyl-1-pyrazolyl]-4-(2-pyridinyl)pyrimidine IUPAC Name: 2-[4-[(4-chlorophenyl)methylsulfanyl]-3,5-dimethylpyrazol-1-yl]-4-pyridin-2-ylpyrimidine Traditional Name: 2-[4-[(4-chlorobenzyl)thio]-3,5-dimethyl-pyrazol-1-yl]-4-(2-pyridyl)pyrimidine Formula: C21H18ClN5S MolecularWeight: 407.91912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NC=CC(=N2)C3=CC=CC=N3)C)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=NC=CC(=N2)C3=CC=CC=N3)C)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN5S/c1-14-20(28-13-16-6-8-17(22)9-7-16)15(2)27(26-14)21-24-12-10-19(25-21)18-5-3-4-11-23-18/h3-12H,13H2,1-2H3