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

Systemtic Name: 2-[methyl-[3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]amino]ethanol Openeye Name: 2-[methyl-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]amino]ethanol CAS Name: 2-[methyl-[3-[4-(3-methyl-4-phenoxyanilino)-6-quinazolinyl]prop-2-ynyl]amino]ethanol IUPAC Name: 2-[methyl-[3-[4-(3-methyl-4-phenoxyanilino)quinazolin-6-yl]prop-2-ynyl]amino]ethanol Traditional Name: 2-[methyl-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]amino]ethanol Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN(C)CCO)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN(C)CCO)OC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2/c1-20-17-22(11-13-26(20)33-23-8-4-3-5-9-23)30-27-24-18-21(7-6-14-31(2)15-16-32)10-12-25(24)28-19-29-27/h3-5,8-13,17-19,32H,14-16H2,1-2H3,(H,28,29,30)