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

Systemtic Name: 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-phenyl-propan-1-one Openeye Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-phenyl-propan-1-one CAS Name: 2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-phenyl-1-propanone IUPAC Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-phenylpropan-1-one Traditional Name: 2-[(1-cyclopropyltetrazol-5-yl)thio]-1-phenyl-propan-1-one Formula: C13H14N4OS MolecularWeight: 274.34146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)SC2=NN=NN2C3CC3

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)SC2=NN=NN2C3CC3

InChI

InChI=1S/C13H14N4OS/c1-9(12(18)10-5-3-2-4-6-10)19-13-14-15-16-17(13)11-7-8-11/h2-6,9,11H,7-8H2,1H3