4-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[1-oxo-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C21H19N5O2S MolecularWeight: 405.47286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)N2CC(=O)NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)N2CC(=O)NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O2S/c1-2-12-25-20(15-8-4-3-5-9-15)23-24-21(25)29-14-19(28)26-13-18(27)22-16-10-6-7-11-17(16)26/h2-11H,1,12-14H2,(H,22,27)