2-[(3,4-dichlorophenyl)methylsulfanyl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C18H16Cl2N2OS MolecularWeight: 379.30344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CSCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CSCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16Cl2N2OS/c19-15-7-6-13(10-16(15)20)11-24-12-18(23)22-9-8-17(21-22)14-4-2-1-3-5-14/h1-7,10H,8-9,11-12H2