3-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[2-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]-4-quinazolinone IUPAC Name: 3-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxoethyl]quinazolin-4-one Traditional Name: 3-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-ethyl]quinazolin-4-one Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CN2C=NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)CN2C=NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2/c27-21(16-26-17-23-20-10-5-4-9-19(20)22(26)28)25-12-6-11-24(13-14-25)15-18-7-2-1-3-8-18/h1-5,7-10,17H,6,11-16H2