1-(4-bromophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one

Systemtic Name: 1-(4-bromophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one Openeye Name: 1-(4-bromophenyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one CAS Name: 1-(4-bromophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-propanone IUPAC Name: 1-(4-bromophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one Traditional Name: 1-(4-bromophenyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]propan-1-one Formula: C18H16BrN3OS MolecularWeight: 402.30814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrN3OS/c1-12-5-3-4-6-16(12)22-11-20-21-18(22)24-13(2)17(23)14-7-9-15(19)10-8-14/h3-11,13H,1-2H3