3-[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]quinazolin-4-one

Systemtic Name: 3-[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]quinazolin-4-one Openeye Name: 3-[(1S)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[(2S)-1-(1-azepanyl)-1-oxopropan-2-yl]-4-quinazolinone IUPAC Name: 3-[(2S)-1-(azepan-1-yl)-1-oxopropan-2-yl]quinazolin-4-one Traditional Name: 3-[(1S)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]quinazolin-4-one Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C[C@@H](C(=O)N1CCCCCC1)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H21N3O2/c1-13(16(21)19-10-6-2-3-7-11-19)20-12-18-15-9-5-4-8-14(15)17(20)22/h4-5,8-9,12-13H,2-3,6-7,10-11H2,1H3/t13-/m0/s1