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

Systemtic Name: 4-[(1-ethyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 4-[(1-ethyltetrazol-5-yl)sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 4-[[(1-ethyl-5-tetrazolyl)thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[(1-ethyltetrazol-5-yl)sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 4-[[(1-ethyltetrazol-5-yl)thio]methyl]-7-methyl-coumarin Formula: C14H14N4O2S MolecularWeight: 302.35156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)SCC2=CC(=O)OC3=C2C=CC(=C3)C

Isomeric SMILES

CCN1C(=NN=N1)SCC2=CC(=O)OC3=C2C=CC(=C3)C

InChI

InChI=1S/C14H14N4O2S/c1-3-18-14(15-16-17-18)21-8-10-7-13(19)20-12-6-9(2)4-5-11(10)12/h4-7H,3,8H2,1-2H3