(2S)-2-methyl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]butanamide

Systemtic Name: (2S)-2-methyl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]butanamide Openeye Name: (2S)-2-methyl-N-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methyl]butanamide CAS Name: (2S)-2-methyl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]butanamide IUPAC Name: (2S)-2-methyl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]butanamide Traditional Name: (2S)-2-methyl-N-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methyl]butyramide Formula: C13H17N5O MolecularWeight: 259.30698

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCC1=NC(=NN1)C2=CC=NC=C2

Isomeric SMILES

CC[C@H](C)C(=O)NCC1=NC(=NN1)C2=CC=NC=C2

InChI

InChI=1S/C13H17N5O/c1-3-9(2)13(19)15-8-11-16-12(18-17-11)10-4-6-14-7-5-10/h4-7,9H,3,8H2,1-2H3,(H,15,19)(H,16,17,18)/t9-/m0/s1