(2R)-N-tert-butyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide

Systemtic Name: (2R)-N-tert-butyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-N-tert-butyl-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-tert-butyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-N-tert-butyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-benzyl-N-tert-butyl-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C23H29N5OS MolecularWeight: 423.57426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)N(CC2=CC=CC=C2)C(C)(C)C)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)N(CC2=CC=CC=C2)C(C)(C)C)C3=CC=NC=C3

InChI

InChI=1S/C23H29N5OS/c1-6-27-20(19-12-14-24-15-13-19)25-26-22(27)30-17(2)21(29)28(23(3,4)5)16-18-10-8-7-9-11-18/h7-15,17H,6,16H2,1-5H3/t17-/m1/s1