2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-pyrrolidino-ethanone Formula: C8H13N5OS MolecularWeight: 227.28672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C8H13N5OS/c9-7-10-8(12-11-7)15-5-6(14)13-3-1-2-4-13/h1-5H2,(H3,9,10,11,12)