7-[5-(4-bromophenyl)furan-2-yl]-3-(phenylmethyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

Systemtic Name: 7-[5-(4-bromophenyl)furan-2-yl]-3-(phenylmethyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Openeye Name: 3-benzyl-7-[5-(4-bromophenyl)-2-furyl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one CAS Name: 7-[5-(4-bromophenyl)-2-furanyl]-3-(phenylmethyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one IUPAC Name: 3-benzyl-7-[5-(4-bromophenyl)furan-2-yl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Traditional Name: 3-benzyl-7-[5-(4-bromophenyl)-2-furyl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Formula: C21H13BrN4O2S MolecularWeight: 465.32252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C3N(C2=O)N=C(S3)C4=CC=C(O4)C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C3N(C2=O)N=C(S3)C4=CC=C(O4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C21H13BrN4O2S/c22-15-8-6-14(7-9-15)17-10-11-18(28-17)19-25-26-20(27)16(23-24-21(26)29-19)12-13-4-2-1-3-5-13/h1-11H,12H2