6-bromanyl-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-6-bromo-quinazolin-4-one CAS Name: 6-bromo-3-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-4-quinazolinone IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-bromoquinazolin-4-one Traditional Name: 3-[2-(4-benzylpiperidino)-2-keto-ethyl]-6-bromo-quinazolin-4-one Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C22H22BrN3O2/c23-18-6-7-20-19(13-18)22(28)26(15-24-20)14-21(27)25-10-8-17(9-11-25)12-16-4-2-1-3-5-16/h1-7,13,15,17H,8-12,14H2