2-[5-[(4-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]benzo[f]chromen-3-one

Systemtic Name: 2-[5-[(4-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]benzo[f]chromen-3-one Openeye Name: 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]benzo[f]chromen-3-one CAS Name: 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]-3-benzo[f][1]benzopyranone IUPAC Name: 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]benzo[f]chromen-3-one Traditional Name: 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]benzo[f]chromen-3-one Formula: C21H12BrN3O2S MolecularWeight: 450.30788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C=C(C(=O)O3)C4=NN=C(S4)NC5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C=C(C(=O)O3)C4=NN=C(S4)NC5=CC=C(C=C5)Br

InChI

InChI=1S/C21H12BrN3O2S/c22-13-6-8-14(9-7-13)23-21-25-24-19(28-21)17-11-16-15-4-2-1-3-12(15)5-10-18(16)27-20(17)26/h1-11H,(H,23,25)