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

Systemtic Name: 4-[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-4-quinazolinyl]-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-[6-methoxy-7-(3-pyrrolidinopropoxy)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C28H33F3N6O3 MolecularWeight: 558.59523

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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)C(F)(F)F)OCCCN5CCCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C(F)(F)F)OCCCN5CCCC5

InChI

InChI=1S/C28H33F3N6O3/c1-39-24-17-22-23(18-25(24)40-16-4-11-35-9-2-3-10-35)32-19-33-26(22)36-12-14-37(15-13-36)27(38)34-21-7-5-20(6-8-21)28(29,30)31/h5-8,17-19H,2-4,9-16H2,1H3,(H,34,38)