(2R)-N-aminocarbonyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-carbamoyl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-carbamoyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-carbamoyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-carbamoyl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C11H12N6O2S MolecularWeight: 292.31698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NNC(=N1)C2=CC=NC=C2

Isomeric SMILES

C[C@H](C(=O)NC(=O)N)SC1=NNC(=N1)C2=CC=NC=C2

InChI

InChI=1S/C11H12N6O2S/c1-6(9(18)15-10(12)19)20-11-14-8(16-17-11)7-2-4-13-5-3-7/h2-6H,1H3,(H,14,16,17)(H3,12,15,18,19)/t6-/m1/s1