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

Systemtic Name: 4-[(2R)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[(2R)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[(2R)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[(2R)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[(2R)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SC(C)C(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)S[C@H](C)C(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

InChI

InChI=1S/C22H29N5O2S/c1-14(30-21-25-24-15(2)26(21)16-10-6-5-7-11-16)19(28)27-18-13-9-8-12-17(18)23-20(29)22(27,3)4/h8-9,12-14,16H,5-7,10-11H2,1-4H3,(H,23,29)/t14-/m1/s1