N-[3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]ethanamide

Systemtic Name: N-[3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]ethanamide Openeye Name: N-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]acetamide CAS Name: N-[3-[4-(3-methyl-4-phenoxyanilino)-6-quinazolinyl]prop-2-ynyl]acetamide IUPAC Name: N-[3-[4-(3-methyl-4-phenoxyanilino)quinazolin-6-yl]prop-2-ynyl]acetamide Traditional Name: N-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]acetamide Formula: C26H22N4O2 MolecularWeight: 422.47848

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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)C)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCNC(=O)C)OC4=CC=CC=C4

InChI

InChI=1S/C26H22N4O2/c1-18-15-21(11-13-25(18)32-22-8-4-3-5-9-22)30-26-23-16-20(7-6-14-27-19(2)31)10-12-24(23)28-17-29-26/h3-5,8-13,15-17H,14H2,1-2H3,(H,27,31)(H,28,29,30)