2-[5-[4-[4-(4-chlorophenyl)sulfanyl-1-phenyl-pyrazol-3-yl]phenyl]pyrazin-2-yl]propan-2-ol

Systemtic Name: 2-[5-[4-[4-(4-chlorophenyl)sulfanyl-1-phenyl-pyrazol-3-yl]phenyl]pyrazin-2-yl]propan-2-ol Openeye Name: 2-[5-[4-[4-(4-chlorophenyl)sulfanyl-1-phenyl-pyrazol-3-yl]phenyl]pyrazin-2-yl]propan-2-ol CAS Name: 2-[5-[4-[4-[(4-chlorophenyl)thio]-1-phenyl-3-pyrazolyl]phenyl]-2-pyrazinyl]-2-propanol IUPAC Name: 2-[5-[4-[4-(4-chlorophenyl)sulfanyl-1-phenylpyrazol-3-yl]phenyl]pyrazin-2-yl]propan-2-ol Traditional Name: 2-[5-[4-[4-[(4-chlorophenyl)thio]-1-phenyl-pyrazol-3-yl]phenyl]pyrazin-2-yl]propan-2-ol Formula: C28H23ClN4OS MolecularWeight: 499.02642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC=C(N=C1)C2=CC=C(C=C2)C3=NN(C=C3SC4=CC=C(C=C4)Cl)C5=CC=CC=C5)O

Isomeric SMILES

CC(C)(C1=NC=C(N=C1)C2=CC=C(C=C2)C3=NN(C=C3SC4=CC=C(C=C4)Cl)C5=CC=CC=C5)O

InChI

InChI=1S/C28H23ClN4OS/c1-28(2,34)26-17-30-24(16-31-26)19-8-10-20(11-9-19)27-25(35-23-14-12-21(29)13-15-23)18-33(32-27)22-6-4-3-5-7-22/h3-18,34H,1-2H3