3-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]chromen-2-one

Systemtic Name: 3-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]chromen-2-one Openeye Name: 3-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]chromen-2-one CAS Name: 3-[1-oxo-2-[(1-phenyl-5-tetrazolyl)thio]ethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]chromen-2-one Traditional Name: 3-[2-[(1-phenyltetrazol-5-yl)thio]acetyl]coumarin Formula: C18H12N4O3S MolecularWeight: 364.37788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C18H12N4O3S/c23-15(14-10-12-6-4-5-9-16(12)25-17(14)24)11-26-18-19-20-21-22(18)13-7-2-1-3-8-13/h1-10H,11H2