3-(4-chlorophenyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(4-chlorophenyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(4-chlorophenyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide Formula: C25H19ClN4OS MolecularWeight: 458.96256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5)C

InChI

InChI=1S/C25H19ClN4OS/c1-15-12-16(2)22-21(13-15)32-25(27-22)28-24(31)20-14-30(19-6-4-3-5-7-19)29-23(20)17-8-10-18(26)11-9-17/h3-14H,1-2H3,(H,27,28,31)