3,3-dimethyl-4-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-1H-quinoxalin-2-one Openeye Name: 4-[2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[1-oxo-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-1H-quinoxalin-2-one Traditional Name: 4-[2-[(4-allyl-1,2,4-triazol-3-yl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C18H21N5O2S MolecularWeight: 371.45664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NN=CN3CC=C

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NN=CN3CC=C

InChI

InChI=1S/C18H21N5O2S/c1-5-10-22-11-19-21-17(22)26-12(2)15(24)23-14-9-7-6-8-13(14)20-16(25)18(23,3)4/h5-9,11-12H,1,10H2,2-4H3,(H,20,25)