3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanal

Systemtic Name: 3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanal Openeye Name: 3-(1-phenyltetrazol-5-yl)sulfanylpropanal CAS Name: 3-[(1-phenyl-5-tetrazolyl)thio]propanal IUPAC Name: 3-(1-phenyltetrazol-5-yl)sulfanylpropanal Traditional Name: 3-[(1-phenyltetrazol-5-yl)thio]propionaldehyde Formula: C10H10N4OS MolecularWeight: 234.2776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCCC=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCCC=O

InChI

InChI=1S/C10H10N4OS/c15-7-4-8-16-10-11-12-13-14(10)9-5-2-1-3-6-9/h1-3,5-7H,4,8H2