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

Systemtic Name: 2-[[4-azanyl-5-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-ethanamide Openeye Name: 2-[[4-amino-5-(4-oxo-4-phenyl-butyl)sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-acetamide CAS Name: 2-[[4-amino-5-[(4-oxo-4-phenylbutyl)thio]-1,2,4-triazol-3-yl]thio]-N,N-diethylacetamide IUPAC Name: 2-[[4-amino-5-(4-oxo-4-phenylbutyl)sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[[4-amino-5-[(4-keto-4-phenyl-butyl)thio]-1,2,4-triazol-3-yl]thio]-N,N-diethyl-acetamide Formula: C18H25N5O2S2 MolecularWeight: 407.5534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NN=C(N1N)SCCCC(=O)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(=O)CSC1=NN=C(N1N)SCCCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H25N5O2S2/c1-3-22(4-2)16(25)13-27-18-21-20-17(23(18)19)26-12-8-11-15(24)14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-13,19H2,1-2H3