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

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]-1-pyrrolidino-ethanone Formula: C13H15N5OS MolecularWeight: 289.3561

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C13H15N5OS/c19-12(17-8-4-5-9-17)10-20-13-14-15-16-18(13)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2