(2S)-N-(ethylcarbamoyl)-2-phenyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H18N6O2S MolecularWeight: 382.43952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)SC2=NNC(=N2)C3=CC=NC=C3

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)SC2=NNC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C18H18N6O2S/c1-2-20-17(26)22-16(25)14(12-6-4-3-5-7-12)27-18-21-15(23-24-18)13-8-10-19-11-9-13/h3-11,14H,2H2,1H3,(H,21,23,24)(H2,20,22,25,26)/t14-/m0/s1