N-[(1S)-1-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[(1S)-1-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethyl]-3-methylsulfanyl-propanamide Openeye Name: N-[(1S)-1-[5-methyl-1-(o-tolyl)pyrazol-4-yl]ethyl]-3-methylsulfanyl-propanamide CAS Name: N-[(1S)-1-[5-methyl-1-(2-methylphenyl)-4-pyrazolyl]ethyl]-3-(methylthio)propanamide IUPAC Name: N-[(1S)-1-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethyl]-3-methylsulfanylpropanamide Traditional Name: N-[(1S)-1-[5-methyl-1-(o-tolyl)pyrazol-4-yl]ethyl]-3-(methylthio)propionamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=N2)C(C)NC(=O)CCSC)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=N2)[C@H](C)NC(=O)CCSC)C

InChI

InChI=1S/C17H23N3OS/c1-12-7-5-6-8-16(12)20-14(3)15(11-18-20)13(2)19-17(21)9-10-22-4/h5-8,11,13H,9-10H2,1-4H3,(H,19,21)/t13-/m0/s1