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

Systemtic Name: (2S)-N,N-diethyl-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: (2S)-N,N-diethyl-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: (2S)-N,N-diethyl-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-2-phenylacetamide IUPAC Name: (2S)-N,N-diethyl-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide Traditional Name: (2S)-N,N-diethyl-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=NC=C3

Isomeric SMILES

CCN(CC)C(=O)[C@H](C1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=NC=C3

InChI

InChI=1S/C20H23N5OS/c1-4-25(5-2)19(26)17(15-9-7-6-8-10-15)27-20-23-22-18(24(20)3)16-11-13-21-14-12-16/h6-14,17H,4-5H2,1-3H3/t17-/m0/s1