N-ethyl-N-phenyl-2-[[4-(phenylmethyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-ethyl-N-phenyl-2-[[4-(phenylmethyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-phenyl-acetamide CAS Name: N-ethyl-N-phenyl-2-[[4-(phenylmethyl)-5-(1-pyrrolidinylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-benzyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-phenylacetamide Traditional Name: 2-[[4-benzyl-5-(pyrrolidinomethyl)-1,2,4-triazol-3-yl]thio]-N-ethyl-N-phenyl-acetamide Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2CC3=CC=CC=C3)CN4CCCC4

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2CC3=CC=CC=C3)CN4CCCC4

InChI

InChI=1S/C24H29N5OS/c1-2-28(21-13-7-4-8-14-21)23(30)19-31-24-26-25-22(18-27-15-9-10-16-27)29(24)17-20-11-5-3-6-12-20/h3-8,11-14H,2,9-10,15-19H2,1H3