2-[[5-[(4-bromanylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: 2-[[5-[(4-bromanylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 2-[[5-[(4-bromophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]tetralin-1-one CAS Name: 2-[[5-[(4-bromophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 2-[[5-[(4-bromophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3,4-dihydro-2H-naphthalen-1-one Traditional Name: 2-[[5-[(4-bromophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]tetralin-1-one Formula: C20H18BrN3O2S MolecularWeight: 444.34482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2CCC3=CC=CC=C3C2=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

CN1C(=NN=C1SC2CCC3=CC=CC=C3C2=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H18BrN3O2S/c1-24-18(12-26-15-9-7-14(21)8-10-15)22-23-20(24)27-17-11-6-13-4-2-3-5-16(13)19(17)25/h2-5,7-10,17H,6,11-12H2,1H3