4-[[2-azanyl-3-[2-oxidanylidene-2-(2-oxidanylpropylamino)ethyl]-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-(6-oxidanylhexyl)butanamide

Systemtic Name: 4-[[2-azanyl-3-[2-oxidanylidene-2-(2-oxidanylpropylamino)ethyl]-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-(6-oxidanylhexyl)butanamide Openeye Name: 4-[[2-amino-3-[2-(2-hydroxypropylamino)-2-oxo-ethyl]-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-(6-hydroxyhexyl)butanamide CAS Name: 4-[[2-amino-3-[2-(2-hydroxypropylamino)-2-oxoethyl]-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-(6-hydroxyhexyl)butanamide IUPAC Name: 4-[[2-amino-3-[2-(2-hydroxypropylamino)-2-oxoethyl]-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-(6-hydroxyhexyl)butanamide Traditional Name: 4-[[2-amino-3-[2-(2-hydroxypropylamino)-2-keto-ethyl]-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-(6-hydroxyhexyl)butyramide Formula: C29H47N5O5 MolecularWeight: 545.71398

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CN1CC2=C(C=CC(=C2)OCCCC(=O)N(CCCCCCO)C3CCCCC3)N=C1N)O

Isomeric SMILES

CC(CNC(=O)CN1CC2=C(C=CC(=C2)OCCCC(=O)N(CCCCCCO)C3CCCCC3)N=C1N)O

InChI

InChI=1S/C29H47N5O5/c1-22(36)19-31-27(37)21-33-20-23-18-25(13-14-26(23)32-29(33)30)39-17-9-12-28(38)34(15-7-2-3-8-16-35)24-10-5-4-6-11-24/h13-14,18,22,24,35-36H,2-12,15-17,19-21H2,1H3,(H2,30,32)(H,31,37)