4-[(2S)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[(2S)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[(2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[(2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[(2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[(2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C15H18N6O2S MolecularWeight: 346.40742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NNC(=N3)N

Isomeric SMILES

C[C@@H](C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NNC(=N3)N

InChI

InChI=1S/C15H18N6O2S/c1-8(24-14-18-13(16)19-20-14)11(22)21-10-7-5-4-6-9(10)17-12(23)15(21,2)3/h4-8H,1-3H3,(H,17,23)(H3,16,18,19,20)/t8-/m0/s1