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

Systemtic Name: 7-methyl-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-methyl-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-methyl-4-[[(1-phenyl-5-tetrazolyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-methyl-4-[[(1-phenyltetrazol-5-yl)thio]methyl]coumarin Formula: C18H14N4O2S MolecularWeight: 350.39436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H14N4O2S/c1-12-7-8-15-13(10-17(23)24-16(15)9-12)11-25-18-19-20-21-22(18)14-5-3-2-4-6-14/h2-10H,11H2,1H3