1-(1,3-benzodioxol-5-yl)-N-[[3-(4-bromophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-6-yl]methyl]methanamine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[[3-(4-bromophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-6-yl]methyl]methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[[3-(4-bromophenyl)thiazolo[2,3-c][1,2,4]triazol-6-yl]methyl]methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[[3-(4-bromophenyl)-6-thiazolo[2,3-c][1,2,4]triazolyl]methyl]methanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[[3-(4-bromophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-6-yl]methyl]methanamine Traditional Name: [3-(4-bromophenyl)thiazolo[2,3-c][1,2,4]triazol-6-yl]methyl-piperonyl-amine Formula: C19H15BrN4O2S MolecularWeight: 443.317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=CN4C(=NN=C4S3)C5=CC=C(C=C5)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=CN4C(=NN=C4S3)C5=CC=C(C=C5)Br

InChI

InChI=1S/C19H15BrN4O2S/c20-14-4-2-13(3-5-14)18-22-23-19-24(18)10-15(27-19)9-21-8-12-1-6-16-17(7-12)26-11-25-16/h1-7,10,21H,8-9,11H2