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

Systemtic Name: 4-[2-azanyl-3-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-4H-quinazolin-5-yl]-N,N-dicyclohexyl-4-oxidanylidene-butanamide Openeye Name: 4-[2-amino-3-[2-(isopropylamino)-2-oxo-ethyl]-4H-quinazolin-5-yl]-N,N-dicyclohexyl-4-oxo-butanamide CAS Name: 4-[2-amino-3-[2-oxo-2-(propan-2-ylamino)ethyl]-4H-quinazolin-5-yl]-N,N-dicyclohexyl-4-oxobutanamide IUPAC Name: 4-[2-amino-3-[2-oxo-2-(propan-2-ylamino)ethyl]-4H-quinazolin-5-yl]-N,N-dicyclohexyl-4-oxobutanamide Traditional Name: 4-[2-amino-3-[2-(isopropylamino)-2-keto-ethyl]-4H-quinazolin-5-yl]-N,N-dicyclohexyl-4-keto-butyramide Formula: C29H43N5O3 MolecularWeight: 509.68342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CC2=C(C=CC=C2N=C1N)C(=O)CCC(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

CC(C)NC(=O)CN1CC2=C(C=CC=C2N=C1N)C(=O)CCC(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C29H43N5O3/c1-20(2)31-27(36)19-33-18-24-23(14-9-15-25(24)32-29(33)30)26(35)16-17-28(37)34(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h9,14-15,20-22H,3-8,10-13,16-19H2,1-2H3,(H2,30,32)(H,31,36)