N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[(1S)-1-[4-(1-imidazolyl)phenyl]ethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H23N5O2/c1-16(17-9-11-18(12-10-17)28-14-13-24-15-28)25-22(29)8-4-7-21-26-20-6-3-2-5-19(20)23(30)27-21/h2-3,5-6,9-16H,4,7-8H2,1H3,(H,25,29)(H,26,27,30)/t16-/m0/s1