5-[2-azanyl-3-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-4H-quinazolin-7-yl]-N,N-dihexyl-5-oxidanylidene-pentanamide

Systemtic Name: 5-[2-azanyl-3-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-4H-quinazolin-7-yl]-N,N-dihexyl-5-oxidanylidene-pentanamide Openeye Name: 5-[2-amino-3-[2-(benzylamino)-2-oxo-ethyl]-4H-quinazolin-7-yl]-N,N-dihexyl-5-oxo-pentanamide CAS Name: 5-[2-amino-3-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4H-quinazolin-7-yl]-N,N-dihexyl-5-oxopentanamide IUPAC Name: 5-[2-amino-3-[2-(benzylamino)-2-oxoethyl]-4H-quinazolin-7-yl]-N,N-dihexyl-5-oxopentanamide Traditional Name: 5-[2-amino-3-[2-(benzylamino)-2-keto-ethyl]-4H-quinazolin-7-yl]-N,N-dihexyl-5-keto-valeramide Formula: C34H49N5O3 MolecularWeight: 575.78456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=O)CCCC(=O)C1=CC2=C(CN(C(=N2)N)CC(=O)NCC3=CC=CC=C3)C=C1

Isomeric SMILES

CCCCCCN(CCCCCC)C(=O)CCCC(=O)C1=CC2=C(CN(C(=N2)N)CC(=O)NCC3=CC=CC=C3)C=C1

InChI

InChI=1S/C34H49N5O3/c1-3-5-7-12-21-38(22-13-8-6-4-2)33(42)18-14-17-31(40)28-19-20-29-25-39(34(35)37-30(29)23-28)26-32(41)36-24-27-15-10-9-11-16-27/h9-11,15-16,19-20,23H,3-8,12-14,17-18,21-22,24-26H2,1-2H3,(H2,35,37)(H,36,41)