4-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-6-ethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-6-ethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]-6-ethyl-7-hydroxy-chromen-2-one CAS Name: 4-[[[1-(4-chlorophenyl)-5-tetrazolyl]thio]methyl]-6-ethyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]-6-ethyl-7-hydroxychromen-2-one Traditional Name: 4-[[[1-(4-chlorophenyl)tetrazol-5-yl]thio]methyl]-6-ethyl-7-hydroxy-coumarin Formula: C19H15ClN4O3S MolecularWeight: 414.8654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=C(C=C4)Cl)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C19H15ClN4O3S/c1-2-11-7-15-12(8-18(26)27-17(15)9-16(11)25)10-28-19-21-22-23-24(19)14-5-3-13(20)4-6-14/h3-9,25H,2,10H2,1H3