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

Systemtic Name: 4-[(2R)-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[(2R)-2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[(2R)-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[(2R)-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[(2R)-2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SC(C)C(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

Isomeric SMILES

C[C@H](C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NN=C(N3C4CC4)C(C)C

InChI

InChI=1S/C21H27N5O2S/c1-12(2)17-23-24-20(25(17)14-10-11-14)29-13(3)18(27)26-16-9-7-6-8-15(16)22-19(28)21(26,4)5/h6-9,12-14H,10-11H2,1-5H3,(H,22,28)/t13-/m1/s1