[3-[3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol

Systemtic Name: [3-[3-[4-[(3-methyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol Openeye Name: [3-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol CAS Name: [3-[3-[4-(3-methyl-4-phenoxyanilino)-6-quinazolinyl]prop-2-ynyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol IUPAC Name: [3-[3-[4-(3-methyl-4-phenoxyanilino)quinazolin-6-yl]prop-2-ynyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol Traditional Name: [3-[3-[4-(3-methyl-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol Formula: C30H28N4O2 MolecularWeight: 476.56892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CC5C(C4)C5CO)OC6=CC=CC=C6

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CC5C(C4)C5CO)OC6=CC=CC=C6

InChI

InChI=1S/C30H28N4O2/c1-20-14-22(10-12-29(20)36-23-7-3-2-4-8-23)33-30-24-15-21(9-11-28(24)31-19-32-30)6-5-13-34-16-25-26(17-34)27(25)18-35/h2-4,7-12,14-15,19,25-27,35H,13,16-18H2,1H3,(H,31,32,33)