(6-chloranylpyridin-3-yl)-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (6-chloranylpyridin-3-yl)-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone Openeye Name: (6-chloro-3-pyridyl)-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone CAS Name: (6-chloro-3-pyridinyl)-[4-(6,7-dimethyl-3-phenyl-2-quinoxalinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (6-chloropyridin-3-yl)-[4-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-1,4-diazepan-1-yl]methanone Traditional Name: (6-chloro-3-pyridyl)-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone Formula: C27H26ClN5O MolecularWeight: 471.98124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(C(=N2)C3=CC=CC=C3)N4CCCN(CC4)C(=O)C5=CN=C(C=C5)Cl

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(C(=N2)C3=CC=CC=C3)N4CCCN(CC4)C(=O)C5=CN=C(C=C5)Cl

InChI

InChI=1S/C27H26ClN5O/c1-18-15-22-23(16-19(18)2)31-26(25(30-22)20-7-4-3-5-8-20)32-11-6-12-33(14-13-32)27(34)21-9-10-24(28)29-17-21/h3-5,7-10,15-17H,6,11-14H2,1-2H3