N-(2-methyl-6-propan-2-yl-phenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[[4-(1-pyrazolyl)phenyl]methylthio]acetamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(4-pyrazol-1-ylbenzyl)thio]acetamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C22H25N3OS/c1-16(2)20-7-4-6-17(3)22(20)24-21(26)15-27-14-18-8-10-19(11-9-18)25-13-5-12-23-25/h4-13,16H,14-15H2,1-3H3,(H,24,26)