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

Systemtic Name: (2S)-N-(2-methylpropyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isobutyl-propanamide CAS Name: (2S)-N-(2-methylpropyl)-2-[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2S)-N-(2-methylpropyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-2-[[4-allyl-5-(3-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(N1CC=C)C2=CN=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)SC1=NN=C(N1CC=C)C2=CN=CC=C2

InChI

InChI=1S/C17H23N5OS/c1-5-9-22-15(14-7-6-8-18-11-14)20-21-17(22)24-13(4)16(23)19-10-12(2)3/h5-8,11-13H,1,9-10H2,2-4H3,(H,19,23)/t13-/m0/s1