7,8-dimethyl-4-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 7,8-dimethyl-4-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7,8-dimethyl-4-[[1-(o-tolyl)tetrazol-5-yl]sulfanylmethyl]chromen-2-one CAS Name: 7,8-dimethyl-4-[[[1-(2-methylphenyl)-5-tetrazolyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7,8-dimethyl-4-[[1-(2-methylphenyl)tetrazol-5-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7,8-dimethyl-4-[[[1-(o-tolyl)tetrazol-5-yl]thio]methyl]coumarin Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=CC=C4C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=CC=C4C)C

InChI

InChI=1S/C20H18N4O2S/c1-12-8-9-16-15(10-18(25)26-19(16)14(12)3)11-27-20-21-22-23-24(20)17-7-5-4-6-13(17)2/h4-10H,11H2,1-3H3