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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=N2)SCC3=CC(=O)OC4=C3C=CC(=C4C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=N2)SCC3=CC(=O)OC4=C3C=CC(=C4C)C

InChI

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