3-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-butan-2-yl]quinazolin-4-one

Systemtic Name: 3-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-butan-2-yl]quinazolin-4-one Openeye Name: 3-[(1R)-1-(azepane-1-carbonyl)propyl]quinazolin-4-one CAS Name: 3-[(2R)-1-(1-azepanyl)-1-oxobutan-2-yl]-4-quinazolinone IUPAC Name: 3-[(2R)-1-(azepan-1-yl)-1-oxobutan-2-yl]quinazolin-4-one Traditional Name: 3-[(1R)-1-(azepane-1-carbonyl)propyl]quinazolin-4-one Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O2/c1-2-16(18(23)20-11-7-3-4-8-12-20)21-13-19-15-10-6-5-9-14(15)17(21)22/h5-6,9-10,13,16H,2-4,7-8,11-12H2,1H3/t16-/m1/s1