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(4-hexylphenyl)-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]methanone

(4-hexylphenyl)-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name:(4-hexylphenyl)-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Openeye Name:(4-hexylphenyl)-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
CAS Name:(4-hexylphenyl)-[4-(2,5,6-trimethyl-4-pyrimidinyl)-1,4-diazepan-1-yl]methanone
IUPAC Name:(4-hexylphenyl)-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Traditional Name:(4-hexylphenyl)-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Formula: C25H36N4O
MolecularWeight: 408.57954
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C3=NC(=NC(=C3C)C)C


Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C3=NC(=NC(=C3C)C)C


InChI

InChI=1S/C25H36N4O/c1-5-6-7-8-10-22-11-13-23(14-12-22)25(30)29-16-9-15-28(17-18-29)24-19(2)20(3)26-21(4)27-24/h11-14H,5-10,15-18H2,1-4H3


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