N-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-7-methoxy-8-prop-2-enyl-quinazolin-6-yl]propanamide

Systemtic Name: N-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-7-methoxy-8-prop-2-enyl-quinazolin-6-yl]propanamide Openeye Name: N-[8-allyl-4-[(3-chloro-4-methoxy-phenyl)methylamino]-7-methoxy-quinazolin-6-yl]propanamide CAS Name: N-[4-[(3-chloro-4-methoxyphenyl)methylamino]-7-methoxy-8-prop-2-enyl-6-quinazolinyl]propanamide IUPAC Name: N-[4-[(3-chloro-4-methoxyphenyl)methylamino]-7-methoxy-8-prop-2-enylquinazolin-6-yl]propanamide Traditional Name: N-[8-allyl-4-[(3-chloro-4-methoxy-benzyl)amino]-7-methoxy-quinazolin-6-yl]propionamide Formula: C23H25ClN4O3 MolecularWeight: 440.9226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C2C(=C1)C(=NC=N2)NCC3=CC(=C(C=C3)OC)Cl)CC=C)OC

Isomeric SMILES

CCC(=O)NC1=C(C(=C2C(=C1)C(=NC=N2)NCC3=CC(=C(C=C3)OC)Cl)CC=C)OC

InChI

InChI=1S/C23H25ClN4O3/c1-5-7-15-21-16(11-18(22(15)31-4)28-20(29)6-2)23(27-13-26-21)25-12-14-8-9-19(30-3)17(24)10-14/h5,8-11,13H,1,6-7,12H2,2-4H3,(H,28,29)(H,25,26,27)