2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-2-phenyl-ethanamide

Systemtic Name: 2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-2-phenyl-ethanamide Openeye Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-diethyl-2-phenyl-acetamide CAS Name: 2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N,N-diethyl-2-phenylacetamide IUPAC Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-diethyl-2-phenylacetamide Traditional Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N,N-diethyl-2-phenyl-acetamide Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2CC3=CC=CC=C3)C4CC4

Isomeric SMILES

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2CC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C24H28N4OS/c1-3-27(4-2)23(29)21(19-13-9-6-10-14-19)30-24-26-25-22(20-15-16-20)28(24)17-18-11-7-5-8-12-18/h5-14,20-21H,3-4,15-17H2,1-2H3