N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-3-(3,5-dimethyl-1-pyrazolyl)propanamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-3-(3,5-dimethylpyrazol-1-yl)propionamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C20H20ClN3OS/c1-14-13-15(2)24(23-14)12-11-20(25)22-18-5-3-4-6-19(18)26-17-9-7-16(21)8-10-17/h3-10,13H,11-12H2,1-2H3,(H,22,25)