4-(2-ethyl-5-methyl-pyrazol-3-yl)carbonyl-6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-1,4-diazepan-2-one

Systemtic Name: 4-(2-ethyl-5-methyl-pyrazol-3-yl)carbonyl-6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-1,4-diazepan-2-one Openeye Name: 4-(2-ethyl-5-methyl-pyrazole-3-carbonyl)-6-[(2-fluorophenyl)methoxy]-1-isobutyl-1,4-diazepan-2-one CAS Name: 4-[(2-ethyl-5-methyl-3-pyrazolyl)-oxomethyl]-6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-1,4-diazepan-2-one IUPAC Name: 4-(2-ethyl-5-methylpyrazole-3-carbonyl)-6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-1,4-diazepan-2-one Traditional Name: 4-(2-ethyl-5-methyl-pyrazole-3-carbonyl)-6-(2-fluorobenzyl)oxy-1-isobutyl-1,4-diazepan-2-one Formula: C23H31FN4O3 MolecularWeight: 430.515643

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)C(=O)N2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3F

Isomeric SMILES

CCN1C(=CC(=N1)C)C(=O)N2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3F

InChI

InChI=1S/C23H31FN4O3/c1-5-28-21(10-17(4)25-28)23(30)27-13-19(12-26(11-16(2)3)22(29)14-27)31-15-18-8-6-7-9-20(18)24/h6-10,16,19H,5,11-15H2,1-4H3