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

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-(3-ethoxypropyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-(3-ethoxypropyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide Formula: C19H28N6O3S MolecularWeight: 420.52902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)CSC1=NN=C(N1CCCOCC)C2=CC=NC=C2

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)CSC1=NN=C(N1CCCOCC)C2=CC=NC=C2

InChI

InChI=1S/C19H28N6O3S/c1-4-14(3)21-18(27)22-16(26)13-29-19-24-23-17(15-7-9-20-10-8-15)25(19)11-6-12-28-5-2/h7-10,14H,4-6,11-13H2,1-3H3,(H2,21,22,26,27)/t14-/m0/s1