(2S)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-yl-propanamide

Systemtic Name: (2S)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-yl-propanamide Openeye Name: (2S)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-propanamide CAS Name: (2S)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-propan-2-ylpropanamide IUPAC Name: (2S)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-ylpropanamide Traditional Name: (2S)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-isopropyl-propionamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)SC1=NN=C(N1C2CC2)C3=CC=NC=C3

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)SC1=NN=C(N1C2CC2)C3=CC=NC=C3

InChI

InChI=1S/C16H21N5OS/c1-10(2)18-15(22)11(3)23-16-20-19-14(21(16)13-4-5-13)12-6-8-17-9-7-12/h6-11,13H,4-5H2,1-3H3,(H,18,22)/t11-/m0/s1