3-(2-bromophenyl)-5-[(4-butan-2-yloxyphenyl)methyl]-1,3,4-thiadiazol-2-one

Systemtic Name: 3-(2-bromophenyl)-5-[(4-butan-2-yloxyphenyl)methyl]-1,3,4-thiadiazol-2-one Openeye Name: 3-(2-bromophenyl)-5-[(4-sec-butoxyphenyl)methyl]-1,3,4-thiadiazol-2-one CAS Name: 3-(2-bromophenyl)-5-[(4-butan-2-yloxyphenyl)methyl]-1,3,4-thiadiazol-2-one IUPAC Name: 3-(2-bromophenyl)-5-[(4-butan-2-yloxyphenyl)methyl]-1,3,4-thiadiazol-2-one Traditional Name: 3-(2-bromophenyl)-5-(4-sec-butoxybenzyl)-1,3,4-thiadiazol-2-one Formula: C19H19BrN2O2S MolecularWeight: 419.33536

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)CC2=NN(C(=O)S2)C3=CC=CC=C3Br

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)CC2=NN(C(=O)S2)C3=CC=CC=C3Br

InChI

InChI=1S/C19H19BrN2O2S/c1-3-13(2)24-15-10-8-14(9-11-15)12-18-21-22(19(23)25-18)17-7-5-4-6-16(17)20/h4-11,13H,3,12H2,1-2H3