N-(4-bromophenyl)-4-[6-methoxy-7-(3-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-bromophenyl)-4-[6-methoxy-7-(3-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-bromophenyl)-4-[6-methoxy-7-(3-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-bromophenyl)-4-[6-methoxy-7-[3-(3-pyrrolidinyl)propoxy]-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-bromophenyl)-4-[6-methoxy-7-(3-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-bromophenyl)-4-[6-methoxy-7-(3-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carboxamide Formula: C27H33BrN6O3 MolecularWeight: 569.49332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)Br)OCCCC5CCNC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)Br)OCCCC5CCNC5

InChI

InChI=1S/C27H33BrN6O3/c1-36-24-15-22-23(16-25(24)37-14-2-3-19-8-9-29-17-19)30-18-31-26(22)33-10-12-34(13-11-33)27(35)32-21-6-4-20(28)5-7-21/h4-7,15-16,18-19,29H,2-3,8-14,17H2,1H3,(H,32,35)