2-cyano-N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]ethanamide

Systemtic Name: 2-cyano-N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]ethanamide Openeye Name: 2-cyano-N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]acetamide CAS Name: 2-cyano-N-cyclopropyl-N-[[3-[4-(1-pyrrolidinyl)-6-quinazolinyl]phenyl]methyl]acetamide IUPAC Name: 2-cyano-N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]acetamide Traditional Name: 2-cyano-N-cyclopropyl-N-[3-(4-pyrrolidinoquinazolin-6-yl)benzyl]acetamide Formula: C25H25N5O MolecularWeight: 411.4989

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=NC3=C2C=C(C=C3)C4=CC(=CC=C4)CN(C5CC5)C(=O)CC#N

Isomeric SMILES

C1CCN(C1)C2=NC=NC3=C2C=C(C=C3)C4=CC(=CC=C4)CN(C5CC5)C(=O)CC#N

InChI

InChI=1S/C25H25N5O/c26-11-10-24(31)30(21-7-8-21)16-18-4-3-5-19(14-18)20-6-9-23-22(15-20)25(28-17-27-23)29-12-1-2-13-29/h3-6,9,14-15,17,21H,1-2,7-8,10,12-13,16H2