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

Systemtic Name: 7-bromanyl-4-[[1-(2-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-bromo-4-[[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-bromo-4-[[[1-(2-ethoxyphenyl)-5-tetrazolyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-bromo-4-[[(1-o-phenetyltetrazol-5-yl)thio]methyl]coumarin Formula: C19H15BrN4O3S MolecularWeight: 459.3164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NN=N2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NN=N2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C19H15BrN4O3S/c1-2-26-16-6-4-3-5-15(16)24-19(21-22-23-24)28-11-12-9-18(25)27-17-10-13(20)7-8-14(12)17/h3-10H,2,11H2,1H3