6-bromanyl-4-phenyl-2-[4-(phenylmethyl)piperazin-1-yl]quinazoline

Systemtic Name: 6-bromanyl-4-phenyl-2-[4-(phenylmethyl)piperazin-1-yl]quinazoline Openeye Name: 2-(4-benzylpiperazin-1-yl)-6-bromo-4-phenyl-quinazoline CAS Name: 6-bromo-4-phenyl-2-[4-(phenylmethyl)-1-piperazinyl]quinazoline IUPAC Name: 2-(4-benzylpiperazin-1-yl)-6-bromo-4-phenylquinazoline Traditional Name: 2-(4-benzylpiperazino)-6-bromo-4-phenyl-quinazoline Formula: C25H23BrN4 MolecularWeight: 459.38092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(C=C(C=C4)Br)C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(C=C(C=C4)Br)C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C25H23BrN4/c26-21-11-12-23-22(17-21)24(20-9-5-2-6-10-20)28-25(27-23)30-15-13-29(14-16-30)18-19-7-3-1-4-8-19/h1-12,17H,13-16,18H2