N-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[1-(4-isopropylphenyl)-2-methyl-propyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-methyl-1-p-cumenyl-propyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C(C)C)NC(=O)CSC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C(C)C)NC(=O)CSC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C23H28N4OS/c1-16(2)18-10-12-19(13-11-18)22(17(3)4)25-21(28)14-29-23-26-24-15-27(23)20-8-6-5-7-9-20/h5-13,15-17,22H,14H2,1-4H3,(H,25,28)