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

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-2-phenyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-2-phenyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(1-tert-butyl-5-tetrazolyl)thio]-2-phenyl-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-2-phenyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(1-tert-butyltetrazol-5-yl)thio]-2-phenyl-1-pyrrolidino-ethanone Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)SC(C2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)SC(C2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C17H23N5OS/c1-17(2,3)22-16(18-19-20-22)24-14(13-9-5-4-6-10-13)15(23)21-11-7-8-12-21/h4-6,9-10,14H,7-8,11-12H2,1-3H3