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

Systemtic Name: 2-methyl-N-[3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]propanamide Openeye Name: 2-methyl-N-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]propanamide CAS Name: 2-methyl-N-[3-[4-(3-methyl-4-phenoxyanilino)-6-quinazolinyl]prop-2-ynyl]propanamide IUPAC Name: 2-methyl-N-[3-[4-(3-methyl-4-phenoxyanilino)quinazolin-6-yl]prop-2-ynyl]propanamide Traditional Name: 2-methyl-N-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]propionamide Formula: C28H26N4O2 MolecularWeight: 450.53164

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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(C)C)OC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C28H26N4O2/c1-19(2)28(33)29-15-7-8-21-11-13-25-24(17-21)27(31-18-30-25)32-22-12-14-26(20(3)16-22)34-23-9-5-4-6-10-23/h4-6,9-14,16-19H,15H2,1-3H3,(H,29,33)(H,30,31,32)