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1,3-benzodioxol-5-yl-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone

1,3-benzodioxol-5-yl-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name:1,3-benzodioxol-5-yl-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Openeye Name:1,3-benzodioxol-5-yl-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
CAS Name:1,3-benzodioxol-5-yl-[4-(2,6-dimethyl-5-propan-2-yl-4-pyrimidinyl)-1,4-diazepan-1-yl]methanone
IUPAC Name:1,3-benzodioxol-5-yl-[4-(2,6-dimethyl-5-propan-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Traditional Name:1,3-benzodioxol-5-yl-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Formula: C22H28N4O3
MolecularWeight: 396.48272
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4)C(C)C


Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4)C(C)C


InChI

InChI=1S/C22H28N4O3/c1-14(2)20-15(3)23-16(4)24-21(20)25-8-5-9-26(11-10-25)22(27)17-6-7-18-19(12-17)29-13-28-18/h6-7,12,14H,5,8-11,13H2,1-4H3


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