6-[3-(3,3-dimethoxypyrrolidin-1-yl)propoxy]-N-(3-ethynylphenyl)-7-methoxy-quinazolin-4-amine

Systemtic Name: 6-[3-(3,3-dimethoxypyrrolidin-1-yl)propoxy]-N-(3-ethynylphenyl)-7-methoxy-quinazolin-4-amine Openeye Name: 6-[3-(3,3-dimethoxypyrrolidin-1-yl)propoxy]-N-(3-ethynylphenyl)-7-methoxy-quinazolin-4-amine CAS Name: 6-[3-(3,3-dimethoxy-1-pyrrolidinyl)propoxy]-N-(3-ethynylphenyl)-7-methoxy-4-quinazolinamine IUPAC Name: 6-[3-(3,3-dimethoxypyrrolidin-1-yl)propoxy]-N-(3-ethynylphenyl)-7-methoxyquinazolin-4-amine Traditional Name: [6-[3-(3,3-dimethoxypyrrolidino)propoxy]-7-methoxy-quinazolin-4-yl]-(3-ethynylphenyl)amine Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OCCCN4CCC(C4)(OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OCCCN4CCC(C4)(OC)OC

InChI

InChI=1S/C26H30N4O4/c1-5-19-8-6-9-20(14-19)29-25-21-15-24(23(31-2)16-22(21)27-18-28-25)34-13-7-11-30-12-10-26(17-30,32-3)33-4/h1,6,8-9,14-16,18H,7,10-13,17H2,2-4H3,(H,27,28,29)