7-bromanyl-4-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-bromo-4-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-bromo-4-[[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-bromo-4-[[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]methyl]coumarin Formula: C15H14BrN3O3S MolecularWeight: 396.25896

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

COCCN1C=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C15H14BrN3O3S/c1-21-5-4-19-9-17-18-15(19)23-8-10-6-14(20)22-13-7-11(16)2-3-12(10)13/h2-3,6-7,9H,4-5,8H2,1H3