5-(4-chlorophenyl)-N-[2-(phenylmethylsulfanyl)ethyl]-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[2-(phenylmethylsulfanyl)ethyl]-1H-pyrazole-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[2-(phenylmethylthio)ethyl]-1H-pyrazole-4-carboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide Formula: C19H18ClN3OS MolecularWeight: 371.88372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3OS/c20-16-8-6-15(7-9-16)18-17(12-22-23-18)19(24)21-10-11-25-13-14-4-2-1-3-5-14/h1-9,12H,10-11,13H2,(H,21,24)(H,22,23)