7-bromanyl-4-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 4-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-bromo-chromen-2-one CAS Name: 4-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-7-bromo-1-benzopyran-2-one IUPAC Name: 4-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-bromochromen-2-one Traditional Name: 4-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-7-bromo-coumarin Formula: C18H12BrN3O2S2 MolecularWeight: 446.34078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C18H12BrN3O2S2/c19-12-6-7-14-11(8-16(23)24-15(14)9-12)10-25-18-22-21-17(26-18)20-13-4-2-1-3-5-13/h1-9H,10H2,(H,20,21)