2-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide

Systemtic Name: 2-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Openeye Name: N-(2-phenylpropyl)-2-[[4-(tetrahydrofuran-2-ylmethyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propanamide IUPAC Name: 2-[[4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Traditional Name: N-(2-phenylpropyl)-2-[[4-(tetrahydrofurfuryl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C23H28N4O2S2 MolecularWeight: 456.62402

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NN=C(N1CC2CCCO2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)C(C)SC1=NN=C(N1CC2CCCO2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2S2/c1-16(18-8-4-3-5-9-18)14-24-22(28)17(2)31-23-26-25-21(20-11-7-13-30-20)27(23)15-19-10-6-12-29-19/h3-5,7-9,11,13,16-17,19H,6,10,12,14-15H2,1-2H3,(H,24,28)