N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[2-(dimethylamino)-2-phenylethyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[2-(dimethylamino)-2-phenylethyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H21N5OS2 MolecularWeight: 387.52224

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)CSC1=NNC(=N1)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CN(C)C(CNC(=O)CSC1=NNC(=N1)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C18H21N5OS2/c1-23(2)14(13-7-4-3-5-8-13)11-19-16(24)12-26-18-20-17(21-22-18)15-9-6-10-25-15/h3-10,14H,11-12H2,1-2H3,(H,19,24)(H,20,21,22)