3-chloranyl-2,2-dimethyl-1-[4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one

Systemtic Name: 3-chloranyl-2,2-dimethyl-1-[4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one Openeye Name: 3-chloro-1-[4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 3-chloro-2,2-dimethyl-1-[4-(6-methyl-2-phenyl-5-propan-2-yl-4-pyrimidinyl)-1,4-diazepan-1-yl]-1-propanone IUPAC Name: 3-chloro-2,2-dimethyl-1-[4-(6-methyl-2-phenyl-5-propan-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one Traditional Name: 3-chloro-1-[4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-2,2-dimethyl-propan-1-one Formula: C24H33ClN4O MolecularWeight: 428.99802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCCN(CC3)C(=O)C(C)(C)CCl)C(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCCN(CC3)C(=O)C(C)(C)CCl)C(C)C

InChI

InChI=1S/C24H33ClN4O/c1-17(2)20-18(3)26-21(19-10-7-6-8-11-19)27-22(20)28-12-9-13-29(15-14-28)23(30)24(4,5)16-25/h6-8,10-11,17H,9,12-16H2,1-5H3