2-azanyl-1-[4-[6-bromanyl-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-azanyl-1-[4-[6-bromanyl-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]propan-1-one Openeye Name: 2-amino-1-[4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]propan-1-one CAS Name: 2-amino-1-[4-[6-bromo-4-(2-chlorophenyl)-2-quinazolinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-amino-1-[4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]propan-1-one Traditional Name: 2-amino-1-[4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazino]propan-1-one Formula: C21H21BrClN5O MolecularWeight: 474.78134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC3=C(C=C(C=C3)Br)C(=N2)C4=CC=CC=C4Cl)N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=NC3=C(C=C(C=C3)Br)C(=N2)C4=CC=CC=C4Cl)N

InChI

InChI=1S/C21H21BrClN5O/c1-13(24)20(29)27-8-10-28(11-9-27)21-25-18-7-6-14(22)12-16(18)19(26-21)15-4-2-3-5-17(15)23/h2-7,12-13H,8-11,24H2,1H3