N-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide Openeye Name: N-[2-(4-bromophenyl)-2-oxo-ethyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide CAS Name: N-[2-(4-bromophenyl)-2-oxoethyl]-4-(6,7-dimethoxy-4-quinazolinyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(4-bromophenyl)-2-oxoethyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide Traditional Name: N-[2-(4-bromophenyl)-2-keto-ethyl]-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide Formula: C23H24BrN5O4 MolecularWeight: 514.37176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NCC(=O)C4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NCC(=O)C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C23H24BrN5O4/c1-32-20-11-17-18(12-21(20)33-2)26-14-27-22(17)28-7-9-29(10-8-28)23(31)25-13-19(30)15-3-5-16(24)6-4-15/h3-6,11-12,14H,7-10,13H2,1-2H3,(H,25,31)