4-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-hydroxy-4-[[[1-(2-methoxy-5-methylphenyl)-5-tetrazolyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[[1-(2-methoxy-5-methylphenyl)tetrazol-5-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-4-[[[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]thio]methyl]coumarin Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C19H16N4O4S/c1-11-3-6-16(26-2)15(7-11)23-19(20-21-22-23)28-10-12-8-18(25)27-17-9-13(24)4-5-14(12)17/h3-9,24H,10H2,1-2H3