N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2-phenylsulfanyl-acetamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-2-(phenylthio)acetamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2-phenylsulfanylacetamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]-2-(phenylthio)acetamide Formula: C18H16BrN3OS MolecularWeight: 402.30814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrN3OS/c19-15-8-6-14(7-9-15)11-22-12-16(10-20-22)21-18(23)13-24-17-4-2-1-3-5-17/h1-10,12H,11,13H2,(H,21,23)