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

Systemtic Name: 6-bromanyl-3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-bromo-3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 6-bromo-3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 6-bromo-3-[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]quinazolin-4-one Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4O3/c1-29-17-5-3-16(4-6-17)24-8-10-25(11-9-24)20(27)13-26-14-23-19-7-2-15(22)12-18(19)21(26)28/h2-7,12,14H,8-11,13H2,1H3