5-(4-chlorophenyl)-N-(3-methoxy-4-phenylsulfanyl-phenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-(3-methoxy-4-phenylsulfanyl-phenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-(3-methoxy-4-phenylsulfanyl-phenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[3-methoxy-4-(phenylthio)phenyl]-4-phenyl-3,4-dihydropyrazole-2-carboxamide IUPAC Name: 5-(4-chlorophenyl)-N-(3-methoxy-4-phenylsulfanylphenyl)-4-phenyl-3,4-dihydropyrazole-2-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[3-methoxy-4-(phenylthio)phenyl]-4-phenyl-2-pyrazoline-1-carboxamide Formula: C29H24ClN3O2S MolecularWeight: 514.03776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C29H24ClN3O2S/c1-35-26-18-23(16-17-27(26)36-24-10-6-3-7-11-24)31-29(34)33-19-25(20-8-4-2-5-9-20)28(32-33)21-12-14-22(30)15-13-21/h2-18,25H,19H2,1H3,(H,31,34)