2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2,3,3a,9b-tetrahydro-1H-perimidine

Systemtic Name: 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2,3,3a,9b-tetrahydro-1H-perimidine Openeye Name: 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2,3,3a,9b-tetrahydro-1H-perimidine CAS Name: 2-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-2,3,3a,9b-tetrahydro-1H-perimidine IUPAC Name: 2-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-2,3,3a,9b-tetrahydro-1H-perimidine Traditional Name: 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2,3,3a,9b-tetrahydro-1H-perimidine Formula: C26H21ClN4 MolecularWeight: 424.92474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C4NC5C=CC=C6C5C(=CC=C6)N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C4NC5C=CC=C6C5C(=CC=C6)N4

InChI

InChI=1S/C26H21ClN4/c27-19-14-12-18(13-15-19)25-21(16-31(30-25)20-8-2-1-3-9-20)26-28-22-10-4-6-17-7-5-11-23(29-26)24(17)22/h1-16,22,24,26,28-29H