(2-imidazol-1-ylphenyl)-[(2S)-2-methyl-4-quinazolin-2-yl-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-imidazol-1-ylphenyl)-[(2S)-2-methyl-4-quinazolin-2-yl-1,4-diazepan-1-yl]methanone Openeye Name: (2-imidazol-1-ylphenyl)-[(2S)-2-methyl-4-quinazolin-2-yl-1,4-diazepan-1-yl]methanone CAS Name: [2-(1-imidazolyl)phenyl]-[(2S)-2-methyl-4-(2-quinazolinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (2-imidazol-1-ylphenyl)-[(2S)-2-methyl-4-quinazolin-2-yl-1,4-diazepan-1-yl]methanone Traditional Name: (2-imidazol-1-ylphenyl)-[(2S)-2-methyl-4-quinazolin-2-yl-1,4-diazepan-1-yl]methanone Formula: C24H24N6O MolecularWeight: 412.48696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCCN1C(=O)C2=CC=CC=C2N3C=CN=C3)C4=NC5=CC=CC=C5C=N4

Isomeric SMILES

C[C@H]1CN(CCCN1C(=O)C2=CC=CC=C2N3C=CN=C3)C4=NC5=CC=CC=C5C=N4

InChI

InChI=1S/C24H24N6O/c1-18-16-28(24-26-15-19-7-2-4-9-21(19)27-24)12-6-13-30(18)23(31)20-8-3-5-10-22(20)29-14-11-25-17-29/h2-5,7-11,14-15,17-18H,6,12-13,16H2,1H3/t18-/m0/s1