N-(2-methyl-6-propan-2-yl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C(C)SC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C(C)SC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C21H24N4OS/c1-14(2)18-12-8-9-15(3)19(18)23-20(26)16(4)27-21-24-22-13-25(21)17-10-6-5-7-11-17/h5-14,16H,1-4H3,(H,23,26)