2-methoxy-N-[(E)-3-[4-[(3-methyl-4-oxidanyl-phenyl)amino]quinazolin-6-yl]prop-2-enyl]ethanamide

Systemtic Name: 2-methoxy-N-[(E)-3-[4-[(3-methyl-4-oxidanyl-phenyl)amino]quinazolin-6-yl]prop-2-enyl]ethanamide Openeye Name: N-[(E)-3-[4-(4-hydroxy-3-methyl-anilino)quinazolin-6-yl]allyl]-2-methoxy-acetamide CAS Name: N-[(E)-3-[4-(4-hydroxy-3-methylanilino)-6-quinazolinyl]prop-2-enyl]-2-methoxyacetamide IUPAC Name: N-[(E)-3-[4-(4-hydroxy-3-methylanilino)quinazolin-6-yl]prop-2-enyl]-2-methoxyacetamide Traditional Name: N-[(E)-3-[4-(4-hydroxy-3-methyl-anilino)quinazolin-6-yl]allyl]-2-methoxy-acetamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C=CCNC(=O)COC)O

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)/C=C/CNC(=O)COC)O

InChI

InChI=1S/C21H22N4O3/c1-14-10-16(6-8-19(14)26)25-21-17-11-15(5-7-18(17)23-13-24-21)4-3-9-22-20(27)12-28-2/h3-8,10-11,13,26H,9,12H2,1-2H3,(H,22,27)(H,23,24,25)/b4-3+