2-(4-chloranylpyrazol-1-yl)-N-(2-phenylsulfanylphenyl)butanamide

Systemtic Name: 2-(4-chloranylpyrazol-1-yl)-N-(2-phenylsulfanylphenyl)butanamide Openeye Name: 2-(4-chloropyrazol-1-yl)-N-(2-phenylsulfanylphenyl)butanamide CAS Name: 2-(4-chloro-1-pyrazolyl)-N-[2-(phenylthio)phenyl]butanamide IUPAC Name: 2-(4-chloropyrazol-1-yl)-N-(2-phenylsulfanylphenyl)butanamide Traditional Name: 2-(4-chloropyrazol-1-yl)-N-[2-(phenylthio)phenyl]butyramide Formula: C19H18ClN3OS MolecularWeight: 371.88372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)N3C=C(C=N3)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)N3C=C(C=N3)Cl

InChI

InChI=1S/C19H18ClN3OS/c1-2-17(23-13-14(20)12-21-23)19(24)22-16-10-6-7-11-18(16)25-15-8-4-3-5-9-15/h3-13,17H,2H2,1H3,(H,22,24)