4-[(2R)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[(2R)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[(2R)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[(2R)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-1-oxopropyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[(2R)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[(2R)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]propanoyl]-1,3-dihydroquinoxalin-2-one Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)SC3=NN(C(=N3)C4CC4)C5=CC=CC=C5

Isomeric SMILES

C[C@H](C(=O)N1CC(=O)NC2=CC=CC=C21)SC3=NN(C(=N3)C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C22H21N5O2S/c1-14(21(29)26-13-19(28)23-17-9-5-6-10-18(17)26)30-22-24-20(15-11-12-15)27(25-22)16-7-3-2-4-8-16/h2-10,14-15H,11-13H2,1H3,(H,23,28)/t14-/m1/s1