6-chloranyl-4-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-7-methyl-coumarin Formula: C15H14ClN3O2S MolecularWeight: 335.80856

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

Isomeric SMILES

CCN1C=NN=C1SCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

InChI

InChI=1S/C15H14ClN3O2S/c1-3-19-8-17-18-15(19)22-7-10-5-14(20)21-13-4-9(2)12(16)6-11(10)13/h4-6,8H,3,7H2,1-2H3