(2R)-2-(3,4-dimethylphenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: (2R)-2-(3,4-dimethylphenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: (2R)-2-(3,4-dimethylphenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: (2R)-2-[(3,4-dimethylphenyl)thio]-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: (2R)-2-(3,4-dimethylphenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: (2R)-2-[(3,4-dimethylphenyl)thio]-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC(C)C(=O)NC2=C(N(N=C2C)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S[C@H](C)C(=O)NC2=C(N(N=C2C)C)C)C

InChI

InChI=1S/C17H23N3OS/c1-10-7-8-15(9-11(10)2)22-14(5)17(21)18-16-12(3)19-20(6)13(16)4/h7-9,14H,1-6H3,(H,18,21)/t14-/m1/s1