6-[[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]-4-methyl-chromen-2-one

Systemtic Name: 6-[[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]-4-methyl-chromen-2-one Openeye Name: 6-[[4-(4-bromophenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methoxy]-4-methyl-chromen-2-one CAS Name: 6-[[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 6-[[4-(4-bromophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]-4-methylchromen-2-one Traditional Name: 6-[[4-(4-bromophenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methoxy]-4-methyl-coumarin Formula: C19H14BrN3O3S MolecularWeight: 444.30176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=C(C=C2)OCC3=NNC(=S)N3C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=O)OC2=C1C=C(C=C2)OCC3=NNC(=S)N3C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H14BrN3O3S/c1-11-8-18(24)26-16-7-6-14(9-15(11)16)25-10-17-21-22-19(27)23(17)13-4-2-12(20)3-5-13/h2-9H,10H2,1H3,(H,22,27)