5-(4-chlorophenyl)-N-(4-ethylphenyl)-4-(2-phenylsulfanylethyl)-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-(4-ethylphenyl)-4-(2-phenylsulfanylethyl)-3,4-dihydropyrazole-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-(4-ethylphenyl)-4-(2-phenylsulfanylethyl)-3,4-dihydropyrazole-2-carboxamide CAS Name: 5-(4-chlorophenyl)-N-(4-ethylphenyl)-4-[2-(phenylthio)ethyl]-3,4-dihydropyrazole-2-carboxamide IUPAC Name: 5-(4-chlorophenyl)-N-(4-ethylphenyl)-4-(2-phenylsulfanylethyl)-3,4-dihydropyrazole-2-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-(4-ethylphenyl)-4-[2-(phenylthio)ethyl]-2-pyrazoline-1-carboxamide Formula: C26H26ClN3OS MolecularWeight: 464.02214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)CCSC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)CCSC4=CC=CC=C4

InChI

InChI=1S/C26H26ClN3OS/c1-2-19-8-14-23(15-9-19)28-26(31)30-18-21(16-17-32-24-6-4-3-5-7-24)25(29-30)20-10-12-22(27)13-11-20/h3-15,21H,2,16-18H2,1H3,(H,28,31)