N-[2,3-bis(chloranyl)phenyl]-4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-[2,3-bis(chloranyl)phenyl]-4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepane-1-carboxamide Openeye Name: N-(2,3-dichlorophenyl)-4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)-1,4-diazepane-1-carboxamide CAS Name: N-(2,3-dichlorophenyl)-4-(6-methyl-2-phenyl-5-propan-2-yl-4-pyrimidinyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(2,3-dichlorophenyl)-4-(6-methyl-2-phenyl-5-propan-2-ylpyrimidin-4-yl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2,3-dichlorophenyl)-4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)-1,4-diazepane-1-carboxamide Formula: C26H29Cl2N5O MolecularWeight: 498.44736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCCN(CC3)C(=O)NC4=C(C(=CC=C4)Cl)Cl)C(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCCN(CC3)C(=O)NC4=C(C(=CC=C4)Cl)Cl)C(C)C

InChI

InChI=1S/C26H29Cl2N5O/c1-17(2)22-18(3)29-24(19-9-5-4-6-10-19)31-25(22)32-13-8-14-33(16-15-32)26(34)30-21-12-7-11-20(27)23(21)28/h4-7,9-12,17H,8,13-16H2,1-3H3,(H,30,34)