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

Systemtic Name: 2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-diethyl-2-phenyl-ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-2-phenyl-acetamide CAS Name: 2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N,N-diethyl-2-phenylacetamide IUPAC Name: 2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-diethyl-2-phenylacetamide Traditional Name: 2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N,N-diethyl-2-phenyl-acetamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2C3CC3)C4=CN=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2C3CC3)C4=CN=CC=C4

InChI

InChI=1S/C22H25N5OS/c1-3-26(4-2)21(28)19(16-9-6-5-7-10-16)29-22-25-24-20(27(22)18-12-13-18)17-11-8-14-23-15-17/h5-11,14-15,18-19H,3-4,12-13H2,1-2H3