N-(1H-indol-6-yl)-6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-amine hydrochloride

Systemtic Name: N-(1H-indol-6-yl)-6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-amine hydrochloride Openeye Name: N-(1H-indol-6-yl)-6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-amine hydrochloride CAS Name: N-(1H-indol-6-yl)-6-methoxy-7-[(E)-4-(1-pyrrolidinyl)but-2-enoxy]-4-quinazolinamine hydrochloride IUPAC Name: N-(1H-indol-6-yl)-6-methoxy-7-[(E)-4-pyrrolidin-1-ylbut-2-enoxy]quinazolin-4-amine hydrochloride Traditional Name: 1H-indol-6-yl-[6-methoxy-7-[(E)-4-pyrrolidinobut-2-enoxy]quinazolin-4-yl]amine hydrochloride Formula: C25H28ClN5O2 MolecularWeight: 465.97512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)C=CN4)OCC=CCN5CCCC5.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)C=CN4)OC/C=C/CN5CCCC5.Cl

InChI

InChI=1S/C25H27N5O2.ClH/c1-31-23-15-20-22(16-24(23)32-13-5-4-12-30-10-2-3-11-30)27-17-28-25(20)29-19-7-6-18-8-9-26-21(18)14-19;/h4-9,14-17,26H,2-3,10-13H2,1H3,(H,27,28,29);1H/b5-4+;