3-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol

Systemtic Name: 3-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol Openeye Name: 3-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol CAS Name: 3-[4-(3-chloro-4-phenoxyanilino)-6-quinazolinyl]-1-(2-pyrrolidinyl)-2-propyn-1-ol IUPAC Name: 3-[4-(3-chloro-4-phenoxyanilino)quinazolin-6-yl]-1-pyrrolidin-2-ylprop-2-yn-1-ol Traditional Name: 3-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]-1-pyrrolidin-2-yl-prop-2-yn-1-ol Formula: C27H23ClN4O2 MolecularWeight: 470.95012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)Cl)O

Isomeric SMILES

C1CC(NC1)C(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)Cl)O

InChI

InChI=1S/C27H23ClN4O2/c28-22-16-19(10-13-26(22)34-20-5-2-1-3-6-20)32-27-21-15-18(8-11-23(21)30-17-31-27)9-12-25(33)24-7-4-14-29-24/h1-3,5-6,8,10-11,13,15-17,24-25,29,33H,4,7,14H2,(H,30,31,32)