N-[[(2S)-butan-2-yl]carbamoyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide Formula: C16H21N5O2S MolecularWeight: 347.43524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)CSC1=NN=C(N1C)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)CSC1=NN=C(N1C)C2=CC=CC=C2

InChI

InChI=1S/C16H21N5O2S/c1-4-11(2)17-15(23)18-13(22)10-24-16-20-19-14(21(16)3)12-8-6-5-7-9-12/h5-9,11H,4,10H2,1-3H3,(H2,17,18,22,23)/t11-/m0/s1