2-[[4-azanyl-5-[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-ethanamide Openeye Name: 2-[[4-amino-5-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-acetamide CAS Name: 2-[[4-amino-5-[[(1S)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl]thio]-1,2,4-triazol-3-yl]thio]-N,N-diethylacetamide IUPAC Name: 2-[[4-amino-5-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[[4-amino-5-[[(1S)-2-keto-1-phenyl-2-pyrrolidino-ethyl]thio]-1,2,4-triazol-3-yl]thio]-N,N-diethyl-acetamide Formula: C20H28N6O2S2 MolecularWeight: 448.60532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NN=C(N1N)SC(C2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

CCN(CC)C(=O)CSC1=NN=C(N1N)S[C@@H](C2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H28N6O2S2/c1-3-24(4-2)16(27)14-29-19-22-23-20(26(19)21)30-17(15-10-6-5-7-11-15)18(28)25-12-8-9-13-25/h5-7,10-11,17H,3-4,8-9,12-14,21H2,1-2H3/t17-/m0/s1