N-(4-bromanyl-2-methyl-phenyl)-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H21BrN4OS MolecularWeight: 445.37594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SC(C)C(=O)NC3=C(C=C(C=C3)Br)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SC(C)C(=O)NC3=C(C=C(C=C3)Br)C)C

InChI

InChI=1S/C20H21BrN4OS/c1-12-7-5-6-8-18(12)25-15(4)23-24-20(25)27-14(3)19(26)22-17-10-9-16(21)11-13(17)2/h5-11,14H,1-4H3,(H,22,26)