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

Systemtic Name: 3-[5-[(2-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]-8-methoxy-chromen-2-one Openeye Name: 3-[5-(2-bromoanilino)-1,3,4-thiadiazol-2-yl]-8-methoxy-chromen-2-one CAS Name: 3-[5-(2-bromoanilino)-1,3,4-thiadiazol-2-yl]-8-methoxy-1-benzopyran-2-one IUPAC Name: 3-[5-(2-bromoanilino)-1,3,4-thiadiazol-2-yl]-8-methoxychromen-2-one Traditional Name: 3-[5-(2-bromoanilino)-1,3,4-thiadiazol-2-yl]-8-methoxy-coumarin Formula: C18H12BrN3O3S MolecularWeight: 430.27518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C3=NN=C(S3)NC4=CC=CC=C4Br

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C3=NN=C(S3)NC4=CC=CC=C4Br

InChI

InChI=1S/C18H12BrN3O3S/c1-24-14-8-4-5-10-9-11(17(23)25-15(10)14)16-21-22-18(26-16)20-13-7-3-2-6-12(13)19/h2-9H,1H3,(H,20,22)