4-[[2-azanyl-3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-4H-quinazolin-5-yl]oxy]-N,N-dicyclohexyl-butanamide

Systemtic Name: 4-[[2-azanyl-3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-4H-quinazolin-5-yl]oxy]-N,N-dicyclohexyl-butanamide Openeye Name: 4-[[2-amino-3-[2-(isopropylamino)-2-oxo-ethyl]-4H-quinazolin-5-yl]oxy]-N,N-dicyclohexyl-butanamide CAS Name: 4-[[2-amino-3-[2-oxo-2-(propan-2-ylamino)ethyl]-4H-quinazolin-5-yl]oxy]-N,N-dicyclohexylbutanamide IUPAC Name: 4-[[2-amino-3-[2-oxo-2-(propan-2-ylamino)ethyl]-4H-quinazolin-5-yl]oxy]-N,N-dicyclohexylbutanamide Traditional Name: 4-[[2-amino-3-[2-(isopropylamino)-2-keto-ethyl]-4H-quinazolin-5-yl]oxy]-N,N-dicyclohexyl-butyramide Formula: C29H45N5O3 MolecularWeight: 511.6993

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CC2=C(C=CC=C2OCCCC(=O)N(C3CCCCC3)C4CCCCC4)N=C1N

Isomeric SMILES

CC(C)NC(=O)CN1CC2=C(C=CC=C2OCCCC(=O)N(C3CCCCC3)C4CCCCC4)N=C1N

InChI

InChI=1S/C29H45N5O3/c1-21(2)31-27(35)20-33-19-24-25(32-29(33)30)15-9-16-26(24)37-18-10-17-28(36)34(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h9,15-16,21-23H,3-8,10-14,17-20H2,1-2H3,(H2,30,32)(H,31,35)