7-[[5-[(4-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-chromen-2-one

Systemtic Name: 7-[[5-[(4-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-chromen-2-one Openeye Name: 7-[[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-chromen-2-one CAS Name: 7-[[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 7-[[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethylchromen-2-one Traditional Name: 7-[[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-coumarin Formula: C20H16BrN3O3S MolecularWeight: 458.32834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=NN=C(S3)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=NN=C(S3)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H16BrN3O3S/c1-11-9-18(25)27-19-12(2)16(8-7-15(11)19)26-10-17-23-24-20(28-17)22-14-5-3-13(21)4-6-14/h3-9H,10H2,1-2H3,(H,22,24)