3-chloranyl-4-[[5-(3,5-dimethylphenyl)sulfanyl-3-methyl-1-propan-2-yl-pyrazol-4-yl]methyl]pyridine

Systemtic Name: 3-chloranyl-4-[[5-(3,5-dimethylphenyl)sulfanyl-3-methyl-1-propan-2-yl-pyrazol-4-yl]methyl]pyridine Openeye Name: 3-chloro-4-[[5-(3,5-dimethylphenyl)sulfanyl-1-isopropyl-3-methyl-pyrazol-4-yl]methyl]pyridine CAS Name: 3-chloro-4-[[5-[(3,5-dimethylphenyl)thio]-3-methyl-1-propan-2-yl-4-pyrazolyl]methyl]pyridine IUPAC Name: 3-chloro-4-[[5-(3,5-dimethylphenyl)sulfanyl-3-methyl-1-propan-2-ylpyrazol-4-yl]methyl]pyridine Traditional Name: 3-chloro-4-[[5-[(3,5-dimethylphenyl)thio]-1-isopropyl-3-methyl-pyrazol-4-yl]methyl]pyridine Formula: C21H24ClN3S MolecularWeight: 385.95336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C(C(=NN2C(C)C)C)CC3=C(C=NC=C3)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C(C(=NN2C(C)C)C)CC3=C(C=NC=C3)Cl)C

InChI

InChI=1S/C21H24ClN3S/c1-13(2)25-21(26-18-9-14(3)8-15(4)10-18)19(16(5)24-25)11-17-6-7-23-12-20(17)22/h6-10,12-13H,11H2,1-5H3