2-[[5-(4-chlorophenyl)-3-phenyl-1H-pyrazol-4-yl]methyl]-1,3-benzothiazole

Systemtic Name: 2-[[5-(4-chlorophenyl)-3-phenyl-1H-pyrazol-4-yl]methyl]-1,3-benzothiazole Openeye Name: 2-[[5-(4-chlorophenyl)-3-phenyl-1H-pyrazol-4-yl]methyl]-1,3-benzothiazole CAS Name: 2-[[5-(4-chlorophenyl)-3-phenyl-1H-pyrazol-4-yl]methyl]-1,3-benzothiazole IUPAC Name: 2-[[5-(4-chlorophenyl)-3-phenyl-1H-pyrazol-4-yl]methyl]-1,3-benzothiazole Traditional Name: 2-[[5-(4-chlorophenyl)-3-phenyl-1H-pyrazol-4-yl]methyl]-1,3-benzothiazole Formula: C23H16ClN3S MolecularWeight: 401.91124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=C2CC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=C2CC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H16ClN3S/c24-17-12-10-16(11-13-17)23-18(22(26-27-23)15-6-2-1-3-7-15)14-21-25-19-8-4-5-9-20(19)28-21/h1-13H,14H2,(H,26,27)