2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[(5-tert-butyl-2-methylphenyl)thio]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-(5-tert-butyl-2-methylphenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[(5-tert-butyl-2-methyl-phenyl)thio]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C19H27N3OS MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3OS/c1-12-8-9-15(19(4,5)6)10-16(12)24-11-17(23)20-18-13(2)21-22(7)14(18)3/h8-10H,11H2,1-7H3,(H,20,23)