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

Systemtic Name: 7-methoxy-4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-methoxy-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-methoxy-4-[[(1-methyl-5-tetrazolyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-methoxy-4-[[(1-methyltetrazol-5-yl)thio]methyl]coumarin Formula: C13H12N4O3S MolecularWeight: 304.32438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CN1C(=NN=N1)SCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C13H12N4O3S/c1-17-13(14-15-16-17)21-7-8-5-12(18)20-11-6-9(19-2)3-4-10(8)11/h3-6H,7H2,1-2H3