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

Systemtic Name: (2S)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylpropyl)propanamide Openeye Name: (2S)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isobutyl-propanamide CAS Name: (2S)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-(2-methylpropyl)propanamide IUPAC Name: (2S)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylpropyl)propanamide Traditional Name: (2S)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-isobutyl-propionamide Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5OS/c1-11(2)10-19-16(23)12(3)24-17-21-20-15(22(17)14-4-5-14)13-6-8-18-9-7-13/h6-9,11-12,14H,4-5,10H2,1-3H3,(H,19,23)/t12-/m0/s1