8-methyl-7-oxidanyl-4-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 8-methyl-7-oxidanyl-4-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-hydroxy-4-[[1-(4-isopropylphenyl)tetrazol-5-yl]sulfanylmethyl]-8-methyl-chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[[[1-(4-propan-2-ylphenyl)-5-tetrazolyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-methyl-4-[[1-(4-propan-2-ylphenyl)tetrazol-5-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-8-methyl-4-[[(1-p-cumenyltetrazol-5-yl)thio]methyl]coumarin Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN=NN3C4=CC=C(C=C4)C(C)C)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NN=NN3C4=CC=C(C=C4)C(C)C)O

InChI

InChI=1S/C21H20N4O3S/c1-12(2)14-4-6-16(7-5-14)25-21(22-23-24-25)29-11-15-10-19(27)28-20-13(3)18(26)9-8-17(15)20/h4-10,12,26H,11H2,1-3H3