4-[(2R)-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[(2R)-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[(2R)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[(2R)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[(2R)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[(2R)-2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SC(C)C(=O)N2C3=CC=CC=C3NC(=O)C2(C)C

Isomeric SMILES

CCCCN1C(=O)NN=C1S[C@H](C)C(=O)N2C3=CC=CC=C3NC(=O)C2(C)C

InChI

InChI=1S/C19H25N5O3S/c1-5-6-11-23-17(27)21-22-18(23)28-12(2)15(25)24-14-10-8-7-9-13(14)20-16(26)19(24,3)4/h7-10,12H,5-6,11H2,1-4H3,(H,20,26)(H,21,27)/t12-/m1/s1