N-[3-[2-[(3-methylphenyl)methylsulfanyl]ethanoylamino]phenyl]-2-pyrazol-1-yl-propanamide

Systemtic Name: N-[3-[2-[(3-methylphenyl)methylsulfanyl]ethanoylamino]phenyl]-2-pyrazol-1-yl-propanamide Openeye Name: N-[3-[[2-(m-tolylmethylsulfanyl)acetyl]amino]phenyl]-2-pyrazol-1-yl-propanamide CAS Name: N-[3-[[2-[(3-methylphenyl)methylthio]-1-oxoethyl]amino]phenyl]-2-(1-pyrazolyl)propanamide IUPAC Name: N-[3-[[2-[(3-methylphenyl)methylsulfanyl]acetyl]amino]phenyl]-2-pyrazol-1-ylpropanamide Traditional Name: N-[3-[[2-[(3-methylbenzyl)thio]acetyl]amino]phenyl]-2-pyrazol-1-yl-propionamide Formula: C22H24N4O2S MolecularWeight: 408.51656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCC(=O)NC2=CC(=CC=C2)NC(=O)C(C)N3C=CC=N3

Isomeric SMILES

CC1=CC(=CC=C1)CSCC(=O)NC2=CC(=CC=C2)NC(=O)C(C)N3C=CC=N3

InChI

InChI=1S/C22H24N4O2S/c1-16-6-3-7-18(12-16)14-29-15-21(27)24-19-8-4-9-20(13-19)25-22(28)17(2)26-11-5-10-23-26/h3-13,17H,14-15H2,1-2H3,(H,24,27)(H,25,28)