3-[(2S,3R)-2,3-dimethyl-2-[(1S)-1-oxidanylethyl]aziridin-1-yl]-2-ethyl-quinazolin-4-one

Systemtic Name: 3-[(2S,3R)-2,3-dimethyl-2-[(1S)-1-oxidanylethyl]aziridin-1-yl]-2-ethyl-quinazolin-4-one Openeye Name: 2-ethyl-3-[(2S,3R)-2-[(1S)-1-hydroxyethyl]-2,3-dimethyl-aziridin-1-yl]quinazolin-4-one CAS Name: 2-ethyl-3-[(2S,3R)-2-[(1S)-1-hydroxyethyl]-2,3-dimethyl-1-aziridinyl]-4-quinazolinone IUPAC Name: 2-ethyl-3-[(2S,3R)-2-[(1S)-1-hydroxyethyl]-2,3-dimethylaziridin-1-yl]quinazolin-4-one Traditional Name: 2-ethyl-3-[(2S,3R)-2-[(1S)-1-hydroxyethyl]-2,3-dimethyl-ethylenimin-1-yl]quinazolin-4-one Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1N3C(C3(C)C(C)O)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1N3[C@@H]([C@@]3(C)[C@H](C)O)C

InChI

InChI=1S/C16H21N3O2/c1-5-14-17-13-9-7-6-8-12(13)15(21)18(14)19-10(2)16(19,4)11(3)20/h6-11,20H,5H2,1-4H3/t10-,11+,16+,19?/m1/s1