4-[5-(4-chlorophenyl)-3-(1,3-dioxolan-2-ylmethylsulfanyl)-1H-pyrazol-4-yl]pyridine

Systemtic Name: 4-[5-(4-chlorophenyl)-3-(1,3-dioxolan-2-ylmethylsulfanyl)-1H-pyrazol-4-yl]pyridine Openeye Name: 4-[5-(4-chlorophenyl)-3-(1,3-dioxolan-2-ylmethylsulfanyl)-1H-pyrazol-4-yl]pyridine CAS Name: 4-[5-(4-chlorophenyl)-3-(1,3-dioxolan-2-ylmethylthio)-1H-pyrazol-4-yl]pyridine IUPAC Name: 4-[5-(4-chlorophenyl)-3-(1,3-dioxolan-2-ylmethylsulfanyl)-1H-pyrazol-4-yl]pyridine Traditional Name: 4-[5-(4-chlorophenyl)-3-(1,3-dioxolan-2-ylmethylthio)-1H-pyrazol-4-yl]pyridine Formula: C18H16ClN3O2S MolecularWeight: 373.85654

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)CSC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COC(O1)CSC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H16ClN3O2S/c19-14-3-1-13(2-4-14)17-16(12-5-7-20-8-6-12)18(22-21-17)25-11-15-23-9-10-24-15/h1-8,15H,9-11H2,(H,21,22)