N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(2-methyl-4-oxo-quinazolin-3-yl)benzamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-(2-methyl-4-oxo-3-quinazolinyl)benzamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-(4-keto-2-methyl-quinazolin-3-yl)benzamide Formula: C31H25N5O2 MolecularWeight: 499.5625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC(CC4=CC=CC=C4)C5=NC6=CC=CC=C6N5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N[C@@H](CC4=CC=CC=C4)C5=NC6=CC=CC=C6N5

InChI

InChI=1S/C31H25N5O2/c1-20-32-25-12-6-5-11-24(25)31(38)36(20)23-17-15-22(16-18-23)30(37)35-28(19-21-9-3-2-4-10-21)29-33-26-13-7-8-14-27(26)34-29/h2-18,28H,19H2,1H3,(H,33,34)(H,35,37)/t28-/m0/s1