6-bromanyl-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 6-bromo-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 6-bromo-3-[3-[2-(4-methoxyphenyl)-1-pyrrolidinyl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 6-bromo-3-[3-keto-3-[2-(4-methoxyphenyl)pyrrolidino]propyl]quinazolin-4-one Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C22H22BrN3O3/c1-29-17-7-4-15(5-8-17)20-3-2-11-26(20)21(27)10-12-25-14-24-19-9-6-16(23)13-18(19)22(25)28/h4-9,13-14,20H,2-3,10-12H2,1H3