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

Systemtic Name: 4-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-ethyl-chromen-2-one Openeye Name: 4-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]-7-ethyl-chromen-2-one CAS Name: 4-[[[1-(4-chlorophenyl)-5-tetrazolyl]thio]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]-7-ethylchromen-2-one Traditional Name: 4-[[[1-(4-chlorophenyl)tetrazol-5-yl]thio]methyl]-7-ethyl-coumarin Formula: C19H15ClN4O2S MolecularWeight: 398.866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H15ClN4O2S/c1-2-12-3-8-16-13(10-18(25)26-17(16)9-12)11-27-19-21-22-23-24(19)15-6-4-14(20)5-7-15/h3-10H,2,11H2,1H3