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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)CC#CC1=CC2=C(C=C1)N=CN=C2NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(=O)N(C)CC#CC1=CC2=C(C=C1)N=CN=C2NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

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