4-[[1-(furan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[[1-(furan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 4-[[1-(2-furylmethyl)tetrazol-5-yl]sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 4-[[[1-(2-furanylmethyl)-5-tetrazolyl]thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[[1-(furan-2-ylmethyl)tetrazol-5-yl]sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 4-[[[1-(2-furfuryl)tetrazol-5-yl]thio]methyl]-7-methyl-coumarin Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3CC4=CC=CO4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3CC4=CC=CO4

InChI

InChI=1S/C17H14N4O3S/c1-11-4-5-14-12(8-16(22)24-15(14)7-11)10-25-17-18-19-20-21(17)9-13-3-2-6-23-13/h2-8H,9-10H2,1H3